methyl 11-sulfanylidene-10H-benzo[d][2,1]benzothiazepine-3-carboxylate

Systemtic Name: methyl 11-sulfanylidene-10H-benzo[d][2,1]benzothiazepine-3-carboxylate Openeye Name: methyl 11-thioxo-10H-benzo[d][2,1]benzothiazepine-3-carboxylate CAS Name: 11-sulfanylidene-10H-benzo[d][2,1]benzothiazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 11-sulfanylidene-10H-benzo[d][2,1]benzothiazepine-3-carboxylate Traditional Name: 11-thioxo-10H-benzo[d][2,1]benzothiazepine-3-carboxylic acid methyl ester Formula: C15H11NO2S2 MolecularWeight: 301.38334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=NSC=C3C=CCC(=S)C3=C2C=C1

Isomeric SMILES

COC(=O)C1=CC2=NSC=C3C=CCC(=S)C3=C2C=C1

InChI

InChI=1S/C15H11NO2S2/c1-18-15(17)9-5-6-11-12(7-9)16-20-8-10-3-2-4-13(19)14(10)11/h2-3,5-8H,4H2,1H3