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Benzazepines

Organic heterocyclic compounds consisting of a benzene ring fused to an azepine ring; azepine rings are seven-membered rings with six carbon atoms and one nitrogen atom.
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1

2-Hydroxy Carbamazepine, TRC

CAS: 68011-66-5 Molecular Formula: C15 H12 N2 O2 Molecular Weight (g/mol): 252.27 Synonym: 2-Hydroxy-5H-dibenz[b,f]azepine-5-carboxamide,2-Hydroxycarbamazepine,5H-Dibenz[b,f]azepine-5-carboxamide, 2-hydroxy- IUPAC Name: 3-hydroxybenzo[b][1]benzazepine-11-carboxamide SMILES: NC(=O)N1c2ccccc2C=Cc3cc(O)ccc13

CAS 68011-66-5
Molecular Weight (g/mol) 252.27
SMILES NC(=O)N1c2ccccc2C=Cc3cc(O)ccc13
Synonym 2-Hydroxy-5H-dibenz[b,f]azepine-5-carboxamide,2-Hydroxycarbamazepine,5H-Dibenz[b,f]azepine-5-carboxamide, 2-hydroxy-
IUPAC Name 3-hydroxybenzo[b][1]benzazepine-11-carboxamide
Molecular Formula C15 H12 N2 O2
2

4-Methoxy-2-nitroaniline(2-Nitro-p-anisidine), TRC

CAS: 96-96-8 Molecular Formula: C7 H8 N2 O3 Molecular Weight (g/mol): 168.15 Synonym: Benzenamine, 4-methoxy-2-nitro-,4-Methoxy-2-nitroaniline IUPAC Name: 4-methoxy-2-nitroaniline SMILES: COc1ccc(N)c(c1)[N+](=O)[O-]

CAS 96-96-8
Molecular Weight (g/mol) 168.15
SMILES COc1ccc(N)c(c1)[N+](=O)[O-]
Synonym Benzenamine, 4-methoxy-2-nitro-,4-Methoxy-2-nitroaniline
IUPAC Name 4-methoxy-2-nitroaniline
Molecular Formula C7 H8 N2 O3
3

Imipramine Pamoate, TRC

CAS: 10075-24-8 Molecular Formula: C61H64N4O6 Molecular Weight (g/mol): 949.18 Synonym: 2-Naphthalenecarboxylic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 10,11-dihydro-N,N-dimethyl-5H-dibenz[b,f]azepine-5-propanamine (1:2),2-Naphthoic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine (1:2) (8CI),2-Naphthoic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine (7CI),5H-Dibenz[b,f]azepine, 5-[3-(dimethylamino)propyl]-10,11-dihydro-, 4,4'-methylenebis[3-hydroxy-2-naphthoate] (2:1) (8CI),5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N,N-dimethyl-, 4,4'-methylenebis[3-hydroxy-2-naphthalenecarboxylate] (2:1) (9CI),Imipramine pamoate IUPAC Name: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine SMILES: CN(C)CCCN1c2ccccc2CCc3ccccc13.OC(=O)c4cc5ccccc5c(Cc6c(O)c(cc7ccccc67)C(=O)O)c4O

CAS 10075-24-8
Molecular Weight (g/mol) 949.18
SMILES CN(C)CCCN1c2ccccc2CCc3ccccc13.OC(=O)c4cc5ccccc5c(Cc6c(O)c(cc7ccccc67)C(=O)O)c4O
Synonym 2-Naphthalenecarboxylic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 10,11-dihydro-N,N-dimethyl-5H-dibenz[b,f]azepine-5-propanamine (1:2),2-Naphthoic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine (1:2) (8CI),2-Naphthoic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine (7CI),5H-Dibenz[b,f]azepine, 5-[3-(dimethylamino)propyl]-10,11-dihydro-, 4,4'-methylenebis[3-hydroxy-2-naphthoate] (2:1) (8CI),5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N,N-dimethyl-, 4,4'-methylenebis[3-hydroxy-2-naphthalenecarboxylate] (2:1) (9CI),Imipramine pamoate
IUPAC Name 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
Molecular Formula C61H64N4O6
4

Epinastine Hydrochloride, TRC

CAS: 108929-04-0 Molecular Formula: C16 H15 N3 . Cl H Molecular Weight (g/mol): 285.77 Synonym: (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride,1H-Dibenz[c,f]imidazo[1,5-a]azepin-3-amine, 9,13b-dihydro-, monohydrochloride (9CI),Alesion,Elestat,Epinastine hydrochloride,WAL 801CL IUPAC Name: (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride SMILES: Cl.NC1=NCC2N1c3ccccc3Cc4ccccc24

CAS 108929-04-0
Molecular Weight (g/mol) 285.77
SMILES Cl.NC1=NCC2N1c3ccccc3Cc4ccccc24
Synonym (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride,1H-Dibenz[c,f]imidazo[1,5-a]azepin-3-amine, 9,13b-dihydro-, monohydrochloride (9CI),Alesion,Elestat,Epinastine hydrochloride,WAL 801CL
IUPAC Name (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride
Molecular Formula C16 H15 N3 . Cl H
5

cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine, TRC

CAS: 58955-94-5 Molecular Formula: C15H14N2O3 Molecular Weight (g/mol): 270.28 Synonym: 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11S)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, cis-,rel-(10R,11S)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 5924,cis-10,11-Dihydro-10,11-dihydroxycarbamazepine,cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine,cis-Carbamazepine-10,11-dihydro-10,11-dihydroxide IUPAC Name: (5S,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide SMILES: NC(=O)N1c2ccccc2[C@H](O)[C@H](O)c3ccccc13

CAS 58955-94-5
Molecular Weight (g/mol) 270.28
SMILES NC(=O)N1c2ccccc2[C@H](O)[C@H](O)c3ccccc13
Synonym 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11S)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, cis-,rel-(10R,11S)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 5924,cis-10,11-Dihydro-10,11-dihydroxycarbamazepine,cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine,cis-Carbamazepine-10,11-dihydro-10,11-dihydroxide
IUPAC Name (5S,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
Molecular Formula C15H14N2O3
6

Zilpaterol, TRC

CAS: 119520-05-7 Molecular Formula: C14 H19 N3 O2 Molecular Weight (g/mol): 261.32 Synonym: Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, (6R,7R)-rel-Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, trans-(±)-,RU 42173,Zilpaterol,trans-(±)-Zilpaterol SMILES: CC(C)N[C@@H]1CCN2C(=O)Nc3cccc([C@H]1O)c23

CAS 119520-05-7
Molecular Weight (g/mol) 261.32
SMILES CC(C)N[C@@H]1CCN2C(=O)Nc3cccc([C@H]1O)c23
Synonym Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, (6R,7R)-rel-Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, trans-(±)-,RU 42173,Zilpaterol,trans-(±)-Zilpaterol
Molecular Formula C14 H19 N3 O2
7

Lorcaserin Hydrochloride (>50% ee), TRC

CAS: 846589-98-8 Molecular Formula: C11 H14 Cl N . Cl H Molecular Weight (g/mol): 232.15 Synonym: 1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride (1:1), (1R)-,1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride, (1R)- (9CI),(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride,(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride,APD 356,Lorcaserin hydrochloride IUPAC Name: (5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrochloride SMILES: Cl.C[C@H]1CNCCc2ccc(Cl)cc12

CAS 846589-98-8
Molecular Weight (g/mol) 232.15
SMILES Cl.C[C@H]1CNCCc2ccc(Cl)cc12
Synonym 1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride (1:1), (1R)-,1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride, (1R)- (9CI),(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride,(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride,APD 356,Lorcaserin hydrochloride
IUPAC Name (5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrochloride
Molecular Formula C11 H14 Cl N . Cl H
8

10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide, TRC

CAS: 952740-00-0 Molecular Formula: C17 H14 N2 O3 Molecular Weight (g/mol): 294.3 Synonym: 10-(Acetyloxy)-5H-dibenz[b,f]azepine-5-carboxamide IUPAC Name: 10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide SMILES: CC(=O)OC1=Cc2ccccc2N(C(=O)N)c3ccccc13

CAS 952740-00-0
Molecular Weight (g/mol) 294.3
SMILES CC(=O)OC1=Cc2ccccc2N(C(=O)N)c3ccccc13
Synonym 10-(Acetyloxy)-5H-dibenz[b,f]azepine-5-carboxamide
IUPAC Name 10-Acetoxy-5H-dibenz[b,f]azepine-5-carboxamide
Molecular Formula C17 H14 N2 O3
9

Lofepramine, TRC

CAS: 23047-25-8 Molecular Formula: C26 H27 Cl N2 O Molecular Weight (g/mol): 418.96 Synonym: Acetophenone, 4'-chloro-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]- (8CI),1-(4-Chlorophenyl)-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]ethanone,5-[3-[N-Methyl-N-(p-chlorophenacyl)amino]propyl]-10,11-dihydro-5H-dibenz[b,f]azepine,Amplit,Leo 640,Lofepramine,Lomont,Lopramine,Ethanone, 1-(4-chlorophenyl)-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]- IUPAC Name: 1-(4-chlorophenyl)-2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylamino]ethanone SMILES: CN(CCCN1c2ccccc2CCc3ccccc13)CC(=O)c4ccc(Cl)cc4

CAS 23047-25-8
Molecular Weight (g/mol) 418.96
SMILES CN(CCCN1c2ccccc2CCc3ccccc13)CC(=O)c4ccc(Cl)cc4
Synonym Acetophenone, 4'-chloro-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]- (8CI),1-(4-Chlorophenyl)-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]ethanone,5-[3-[N-Methyl-N-(p-chlorophenacyl)amino]propyl]-10,11-dihydro-5H-dibenz[b,f]azepine,Amplit,Leo 640,Lofepramine,Lomont,Lopramine,Ethanone, 1-(4-chlorophenyl)-2-[[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)propyl]methylamino]-
IUPAC Name 1-(4-chlorophenyl)-2-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylamino]ethanone
Molecular Formula C26 H27 Cl N2 O
10

rac trans-10,11-Dihydro-10,11-dihydroxy Carbamazepine, TRC

CAS: 58955-93-4 Molecular Formula: C15 H14 N2 O3 Molecular Weight (g/mol): 270.28 Synonym: 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11R)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, trans-,rel-(10R,11R)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 10000,Carbamazepine-10,11-dihydro-10,11-dihydroxy,Dihydrocarbamazepine-10,11-trans-diol,trans-10,11-Dihydro-10,11-dihydroxycarbamazepine,trans-10,11-Dihydroxy-10,11-dihydrocarbamazepine,trans-Carbamazepine-10,11-dihydro-10,11-dihydroxide IUPAC Name: (5R,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide SMILES: NC(=O)N1c2ccccc2[C@@H](O)[C@H](O)c3ccccc13

CAS 58955-93-4
Molecular Weight (g/mol) 270.28
SMILES NC(=O)N1c2ccccc2[C@@H](O)[C@H](O)c3ccccc13
Synonym 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11R)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, trans-,rel-(10R,11R)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 10000,Carbamazepine-10,11-dihydro-10,11-dihydroxy,Dihydrocarbamazepine-10,11-trans-diol,trans-10,11-Dihydro-10,11-dihydroxycarbamazepine,trans-10,11-Dihydroxy-10,11-dihydrocarbamazepine,trans-Carbamazepine-10,11-dihydro-10,11-dihydroxide
IUPAC Name (5R,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
Molecular Formula C15 H14 N2 O3
11

N-trifluoroacetyl Varenicline, TRC

CAS: 230615-70-0 Molecular Formula: C15 H12 F3 N3 O Molecular Weight (g/mol): 307.2705 Synonym: Ethanone, 2,2,2-trifluoro-1-(6,7,9,10-tetrahydro-6,10-methano-8H-pyrazino[2,3-h][3]benzazepin-8-yl)-,6,10-Methano-6H-pyrazino[2,3-h][3]benzazepine, 7,8,9,10-tetrahydro-8-(trifluoroacetyl)- (9CI),2,2,2-Trifluoro-1-(6,7,9,10-tetrahydro-6,10-methano-8H-pyrazino[2,3-h][3]benzazepin-8-yl)ethanone IUPAC Name: 2,2,2-trifluoro-1-(5,8,14-triazatetracyclo[10.3.1.02,11.04,9]hexadeca-2,4,6,8,10-pentaen-14-yl)ethanone SMILES: FC(F)(F)C(=O)N1CC2CC(C1)c3cc4nccnc4cc23

CAS 230615-70-0
Molecular Weight (g/mol) 307.2705
SMILES FC(F)(F)C(=O)N1CC2CC(C1)c3cc4nccnc4cc23
Synonym Ethanone, 2,2,2-trifluoro-1-(6,7,9,10-tetrahydro-6,10-methano-8H-pyrazino[2,3-h][3]benzazepin-8-yl)-,6,10-Methano-6H-pyrazino[2,3-h][3]benzazepine, 7,8,9,10-tetrahydro-8-(trifluoroacetyl)- (9CI),2,2,2-Trifluoro-1-(6,7,9,10-tetrahydro-6,10-methano-8H-pyrazino[2,3-h][3]benzazepin-8-yl)ethanone
IUPAC Name 2,2,2-trifluoro-1-(5,8,14-triazatetracyclo[10.3.1.02,11.04,9]hexadeca-2,4,6,8,10-pentaen-14-yl)ethanone
Molecular Formula C15 H12 F3 N3 O
12

N-Demethyl Ivabradine Hydrochloride, TRC

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

CAS 1246638-08-3
Molecular Weight (g/mol) 491.02
InChI Formula InChI=1S/C26H34N2O5.ClH/c1-30-22-11-17-6-9-28(26(29)14-18(17)12-23(22)31-2)8-5-7-27-16-20-10-19-13-24(32-3)25(33-4)15-21(19)20;/h11-13,15,20,27H,5-10,14,16H2,1-4H3;1H/t20-;/m1./s1
Chemical Name or Material N-Demethyl Ivabradine Hydrochloride
SMILES Cl.COc1cc2CCN(CCCNC[C@H]3Cc4cc(OC)c(OC)cc34)C(=O)Cc2cc1OC
Synonym 2H-3-Benzazepin-2-one, 3-[3-[[[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]amino]propyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, hydrobromide (1:1)
Recommended Storage +4°C
IUPAC Name 3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one;hydrochloride
Molecular Formula C26 H34 N2 O5 . Cl H
Formula Weight 490.2234
13

10,11-Dihydro Carbamazepine, TRC

CAS: 3564-73-6 Molecular Formula: C15 H14 N2 O Molecular Weight (g/mol): 238.28 Synonym: 10,11-Dihydro-5H-dibenzo[b,f]-azepine-5-carboxamide,Carbamazepine Imp. A (EP),10,11-Dihydro-carbamazepine,Carbamazepine-10,11-dihydro IUPAC Name: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide SMILES: NC(=O)N1c2ccccc2CCc3ccccc13

CAS 3564-73-6
Molecular Weight (g/mol) 238.28
SMILES NC(=O)N1c2ccccc2CCc3ccccc13
Synonym 10,11-Dihydro-5H-dibenzo[b,f]-azepine-5-carboxamide,Carbamazepine Imp. A (EP),10,11-Dihydro-carbamazepine,Carbamazepine-10,11-dihydro
IUPAC Name 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
Molecular Formula C15 H14 N2 O
14

Desipramine-d3, TRC

CAS: 65100-49-4 Molecular Formula: C18 2H3 H20 N3 Molecular Weight (g/mol): 284.41 Synonym: Desipramine D3 IUPAC Name: N,N-dimethyl-3-(2,3,4-trideuterio-5,6-dihydrobenzo[b][1,4]benzodiazepin-11-yl)propan-1-amine SMILES: [2H]c1cc2N(CCCN(C)C)c3ccccc3CNc2c([2H])c1[2H]

CAS 65100-49-4
Molecular Weight (g/mol) 284.41
SMILES [2H]c1cc2N(CCCN(C)C)c3ccccc3CNc2c([2H])c1[2H]
Synonym Desipramine D3
IUPAC Name N,N-dimethyl-3-(2,3,4-trideuterio-5,6-dihydrobenzo[b][1,4]benzodiazepin-11-yl)propan-1-amine
Molecular Formula C18 2H3 H20 N3