8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione

Systemtic Name: 8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione Openeye Name: 8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione CAS Name: 8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione IUPAC Name: 8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione Traditional Name: 8-nitro-5H-benzo[b][1,4]benzothiazepine-6-thione Formula: C13H8N2O2S2 MolecularWeight: 288.34482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=S)C3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=S)C3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O2S2/c16-15(17)8-5-6-11-9(7-8)13(18)14-10-3-1-2-4-12(10)19-11/h1-7H,(H,14,18)