8-ethyl-7-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 8-ethyl-7-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 8-ethyl-7-nitro-5-(2-pyridyl)-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 8-ethyl-7-nitro-5-(2-pyridinyl)-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 8-ethyl-7-nitro-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 8-ethyl-7-nitro-5-(2-pyridyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)NC(=S)CN=C2C3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C2C(=C1)NC(=S)CN=C2C3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O2S/c1-2-10-7-13-11(8-14(10)20(21)22)16(18-9-15(23)19-13)12-5-3-4-6-17-12/h3-8H,2,9H2,1H3,(H,19,23)