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

Systemtic Name: 1,4,5-trimethyl-7-nitro-3,4-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 1,4,5-trimethyl-7-nitro-3,4-dihydro-1,5-benzodiazepine-2-thione CAS Name: 1,4,5-trimethyl-7-nitro-3,4-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 1,4,5-trimethyl-7-nitro-3,4-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 1,4,5-trimethyl-7-nitro-3,4-dihydro-1,5-benzodiazepine-2-thione Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=S)N(C2=C(N1C)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(=S)N(C2=C(N1C)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H15N3O2S/c1-8-6-12(18)14(3)10-5-4-9(15(16)17)7-11(10)13(8)2/h4-5,7-8H,6H2,1-3H3