7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione

Systemtic Name: 7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 7,8-dimethoxy-4-phenyl-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C17H16N2O2S MolecularWeight: 312.38614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)NC(=S)CC(=N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)NC(=S)CC(=N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C17H16N2O2S/c1-20-15-8-13-14(9-16(15)21-2)19-17(22)10-12(18-13)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H,19,22)