[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C20H16N2O3S2 MolecularWeight: 396.48264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C20H16N2O3S2/c1-12-2-4-13(5-3-12)19-21-15(10-27-19)9-25-20(24)14-6-7-17-16(8-14)22-18(23)11-26-17/h2-8,10H,9,11H2,1H3,(H,22,23)