1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione

Systemtic Name: 1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione Openeye Name: 1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione CAS Name: 1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione IUPAC Name: 1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione Traditional Name: 1,4-dimethyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepine-2-thione Formula: C11H13N3O2S MolecularWeight: 251.30482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=S)N(C2=C(N1)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(=S)N(C2=C(N1)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C11H13N3O2S/c1-7-5-11(17)13(2)10-4-3-8(14(15)16)6-9(10)12-7/h3-4,6-7,12H,5H2,1-2H3