2-(4-methylphenyl)sulfanylethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: 2-(4-methylphenyl)sulfanylethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: 2-(p-tolylsulfanyl)ethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid 2-[(4-methylphenyl)thio]ethyl ester IUPAC Name: 2-(4-methylphenyl)sulfanylethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid 2-(p-tolylthio)ethyl ester Formula: C18H17NO3S2 MolecularWeight: 359.46248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCOC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCOC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C18H17NO3S2/c1-12-2-5-14(6-3-12)23-9-8-22-18(21)13-4-7-16-15(10-13)19-17(20)11-24-16/h2-7,10H,8-9,11H2,1H3,(H,19,20)