7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione

Systemtic Name: 7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione Openeye Name: 7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione CAS Name: 7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione IUPAC Name: 7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione Traditional Name: 7-nitro-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-4-thione Formula: C15H13N3O2S MolecularWeight: 299.34762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(C=C(C=C2)[N+](=O)[O-])NC1=S)C3=CC=CC=C3

Isomeric SMILES

C1C(NC2=C(C=C(C=C2)[N+](=O)[O-])NC1=S)C3=CC=CC=C3

InChI

InChI=1S/C15H13N3O2S/c19-18(20)11-6-7-12-14(8-11)17-15(21)9-13(16-12)10-4-2-1-3-5-10/h1-8,13,16H,9H2,(H,17,21)