2-methoxy-11,11-bis(oxidanylidene)-5H-benzo[b][1,4]benzothiazepine-6-thione

Systemtic Name: 2-methoxy-11,11-bis(oxidanylidene)-5H-benzo[b][1,4]benzothiazepine-6-thione Openeye Name: 2-methoxy-11,11-dioxo-5H-benzo[b][1,4]benzothiazepine-6-thione CAS Name: 2-methoxy-11,11-dioxo-5H-benzo[b][1,4]benzothiazepine-6-thione IUPAC Name: 2-methoxy-11,11-dioxo-5H-benzo[b][1,4]benzothiazepine-6-thione Traditional Name: 11,11-diketo-2-methoxy-5H-benzo[b][1,4]benzothiazepine-6-thione Formula: C14H11NO3S2 MolecularWeight: 305.37204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=S)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=S)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C14H11NO3S2/c1-18-9-6-7-11-13(8-9)20(16,17)12-5-3-2-4-10(12)14(19)15-11/h2-8H,1H3,(H,15,19)