7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione

Systemtic Name: 7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione Openeye Name: 7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione CAS Name: 7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione IUPAC Name: 7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione Traditional Name: 7,8-dimethoxy-3-methyl-1-(4-nitrophenyl)-5H-2,3-benzodiazepine-4-thione Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)CC2=CC(=C(C=C2C(=N1)C3=CC=C(C=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

CN1C(=S)CC2=CC(=C(C=C2C(=N1)C3=CC=C(C=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H17N3O4S/c1-20-17(26)9-12-8-15(24-2)16(25-3)10-14(12)18(19-20)11-4-6-13(7-5-11)21(22)23/h4-8,10H,9H2,1-3H3