7-bromanyl-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione

Systemtic Name: 7-bromanyl-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione Openeye Name: 7-bromo-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione CAS Name: 7-bromo-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione IUPAC Name: 7-bromo-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione Traditional Name: 7-bromo-8-methoxy-1-(4-nitrophenyl)-3,5-dihydro-2,3-benzodiazepine-4-thione Formula: C16H12BrN3O3S MolecularWeight: 406.25378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(=S)NN=C(C2=C1)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C2CC(=S)NN=C(C2=C1)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrN3O3S/c1-23-14-8-12-10(6-13(14)17)7-15(24)18-19-16(12)9-2-4-11(5-3-9)20(21)22/h2-6,8H,7H2,1H3,(H,18,24)