Benzodiazepines

Alfa Aesar™ Clozapine N-oxide, 99%

CAS: 34233-69-7 Molecular Formula: C18H19ClN4O Molecular Weight (g/mol): 342.827 MDL Number: MFCD00210190 InChI Key: WYRDWWAASBTJLM-UHFFFAOYSA-N Synonym: chembl1688 PubChem CID: 2819 IUPAC Name: 3-chloro-6-(4-methyl-4-oxidopiperazin-4-ium-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: C[N+]1(CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl)[O-]

Alfa Aesar™ Clozapine, 98+%

CAS: 5786-21-0 Molecular Formula: C18H19ClN4 Molecular Weight (g/mol): 326.828 MDL Number: MFCD00153785 InChI Key: ZUXABONWMNSFBN-UHFFFAOYSA-N Synonym: asaleptin PubChem CID: 2818 IUPAC Name: 3-chloro-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

Clozapine N-oxide, Tocris Bioscience™

CAS: 34233-69-7 Molecular Formula: C18H19ClN4O Molecular Weight (g/mol): 342.827 InChI Key: WYRDWWAASBTJLM-UHFFFAOYSA-N Synonym: chembl1688 PubChem CID: 2819 IUPAC Name: 3-chloro-6-(4-methyl-4-oxidopiperazin-4-ium-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: C[N+]1(CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl)[O-]

Clozapine, MP Biomedicals

CAS: 5786-21-0 Molecular Formula: C18H19ClN4 Molecular Weight (g/mol): 326.828 InChI Key: ZUXABONWMNSFBN-UHFFFAOYSA-N Synonym: asaleptin PubChem CID: 2818 IUPAC Name: 3-chloro-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

HX 531, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 188844-34-0 Molecular Formula: C29H29N3O4 Molecular Weight (g/mol): 483.568 InChI Key: SXKPGYKPQPYJER-UHFFFAOYSA-N Synonym: 4-5,7,7,10,10-pentamethyl-2-nitro-7,8,9,10-tetrahydro-5h-5,13-diaza-benzo 4,5 cyclohepta 1,2-b naphthalen-12-yl-benzoic acid PubChem CID: 11755040 IUPAC Name: 4-(5,7,7,10,10-pentamethyl-2-nitro-8,9-dihydronaphtho[2,3-b][1,5]benzodiazepin-12-yl)benzoic acid SMILES: CC1(CCC(C2=C1C=C3C(=C2)N(C4=C(C=C(C=C4)[N+](=O)[O-])N=C3C5=CC=C(C=C5)C(=O)O)C)(C)C)C

Alfa Aesar™ Pirenzepine dihydrochloride, 99%

CAS: 29868-97-1 Molecular Formula: C19H23Cl2N5O2 Molecular Weight (g/mol): 424.326 MDL Number: MFCD00055214 InChI Key: FFNMBRCFFADNAO-UHFFFAOYSA-N Synonym: bisvanil PubChem CID: 71405 ChEBI: CHEBI:32014 IUPAC Name: 11-[2-(4-methylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one;dihydrochloride SMILES: CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4.Cl.Cl

Alfa Aesar™ 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine, 95%

CAS: 5946-39-4 Molecular Formula: C9H12N2 Molecular Weight (g/mol): 148.209 MDL Number: MFCD03789577 InChI Key: MLXBHOCKBUILHN-UHFFFAOYSA-N Synonym: 1h-1,4-benzodiazepine, 2,3,4,5-tetrahydro PubChem CID: 2771762 IUPAC Name: 2,3,4,5-tetrahydro-1H-1,4-benzodiazepine SMILES: C1CNC2=CC=CC=C2CN1

Clozapine 98.0+%, TCI America™

CAS: 5786-21-0 Molecular Formula: C18H19ClN4 Molecular Weight (g/mol): 326.828 MDL Number: MFCD00153785 InChI Key: ZUXABONWMNSFBN-UHFFFAOYSA-N Synonym: asaleptin PubChem CID: 2818 IUPAC Name: 3-chloro-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

L-364,373, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 103342-82-1 Molecular Formula: C25H20FN3O Molecular Weight (g/mol): 397.453 InChI Key: CGBANSGENFERAT-JOCHJYFZSA-N Synonym: 3r-5-2-fluorophenyl-3-1h-indol-3-ylmethyl-1-methyl-3h-1,4-benzodiazepin-2-one PubChem CID: 656755 ChEBI: CHEBI:34942 IUPAC Name: (3R)-5-(2-fluorophenyl)-3-(1H-indol-3-ylmethyl)-1-methyl-3H-1,4-benzodiazepin-2-one SMILES: CN1C2=CC=CC=C2C(=NC(C1=O)CC3=CNC4=CC=CC=C43)C5=CC=CC=C5F

AQ-RA 741, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 123548-16-3 Molecular Formula: C27H37N5O2 Molecular Weight (g/mol): 463.626 InChI Key: BCUGCHZRMKTPMU-UHFFFAOYSA-N Synonym: 11-2-4-4-diethylamino butyl piperidin-1-yl acetyl-5h-benzo e pyrido 3,2-b 1,4 diazepin-6 11h-one PubChem CID: 129989 IUPAC Name: 11-[2-[4-[4-(diethylamino)butyl]piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one SMILES: CCN(CC)CCCCC1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

AF-DX 116, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 102394-31-0 Molecular Formula: C24H31N5O2 Molecular Weight (g/mol): 421.545 InChI Key: UBRKDAVQCKZSPO-UHFFFAOYSA-N Synonym: 11-2-2-diethylamino methyl piperidin-1-yl acetyl-5h-benzo e pyrido 3,2-b 1,4 diazepin-6 11h-one PubChem CID: 107867 IUPAC Name: 11-[2-[2-(diethylaminomethyl)piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one SMILES: CCN(CC)CC1CCCCN1CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

R 1530, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 882531-87-5 Molecular Formula: C18H14ClFN4O Molecular Weight (g/mol): 356.785 InChI Key: UOVCGJXDGOGOCZ-UHFFFAOYSA-N Synonym: 5-2-chlorophenyl-1,2-dihydro-7-fluoro-8-methoxy-3-methyl-pyrazolo 3,4-b 1,4 benzodiazepine PubChem CID: 11610113 IUPAC Name: 5-(2-chlorophenyl)-7-fluoro-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine SMILES: CC1=C2C(=NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)F)OC)NN1

Clozapine, Tocris Bioscience™

CAS: 5786-21-0 Molecular Formula: C18H19ClN4 Molecular Weight (g/mol): 326.828 InChI Key: ZUXABONWMNSFBN-UHFFFAOYSA-N Synonym: asaleptin PubChem CID: 2818 IUPAC Name: 3-chloro-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine SMILES: CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

LE 135, Tocris Bioscience™

CAS: 155877-83-1 Molecular Formula: C29H30N2O2 Molecular Weight (g/mol): 438.571 InChI Key: YZZAIQOVMHVWBS-UHFFFAOYSA-N Synonym: 4-5,7,7,10,10-pentamethyl-7,8,9,10-tetrahydro-5h-5,12-diaza-benzo 4,5 cyclohepta 1,2-b naphthalen-13-yl-benzoic acid PubChem CID: 10410894 IUPAC Name: 4-(5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,4]benzodiazepin-13-yl)benzoic acid SMILES: CC1(CCC(C2=CC3=C(C=C21)N=C(C4=CC=CC=C4N3C)C5=CC=C(C=C5)C(=O)O)(C)C)C

Pirenzepine dihydrochloride, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 29868-97-1 Molecular Formula: C19H23Cl2N5O2 Molecular Weight (g/mol): 424.326 InChI Key: FFNMBRCFFADNAO-UHFFFAOYSA-N Synonym: bisvanil PubChem CID: 71405 ChEBI: CHEBI:32014 IUPAC Name: 11-[2-(4-methylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one;dihydrochloride SMILES: CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4.Cl.Cl

L-365,260, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 118101-09-0 Molecular Formula: C24H22N4O2 Molecular Weight (g/mol): 398.466 InChI Key: KDFQABSFVYLGPM-QFIPXVFZSA-N Synonym: 1-3r-1-methyl-2-oxo-5-phenyl-3h-1,4-benzodiazepin-3-yl-3-3-methylphenyl urea PubChem CID: 5311201 ChEBI: CHEBI:79548 IUPAC Name: 1-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea SMILES: CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C

AF-DX 384, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 118290-26-9 Molecular Formula: C27H38N6O2 Molecular Weight (g/mol): 478.641 InChI Key: MZDYABXXPZNUCT-UHFFFAOYSA-N Synonym: 3h af dx-384 PubChem CID: 119357 IUPAC Name: N-[2-[2-[(dipropylamino)methyl]piperidin-1-yl]ethyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide SMILES: CCCN(CCC)CC1CCCCN1CCNC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

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