7-bromanyl-9-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 7-bromanyl-9-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 7-bromo-9-nitro-5-(2-pyridyl)-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 7-bromo-9-nitro-5-(2-pyridinyl)-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 7-bromo-9-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 7-bromo-9-nitro-5-(2-pyridyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C14H9BrN4O2S MolecularWeight: 377.21586

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)NC2=C(C=C(C=C2C(=N1)C3=CC=CC=N3)Br)[N+](=O)[O-]

Isomeric SMILES

C1C(=S)NC2=C(C=C(C=C2C(=N1)C3=CC=CC=N3)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H9BrN4O2S/c15-8-5-9-13(10-3-1-2-4-16-10)17-7-12(22)18-14(9)11(6-8)19(20)21/h1-6H,7H2,(H,18,22)