[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)sulfanylethanoate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)sulfanylethanoate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 2-(p-tolylsulfanyl)acetate CAS Name: 2-[(4-methylphenyl)thio]acetic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 2-(4-methylphenyl)sulfanylacetate Traditional Name: 2-(p-tolylthio)acetic acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C17H15N3O3S2/c1-11-5-7-12(8-6-11)24-10-16(22)23-9-15(21)18-13-3-2-4-14-17(13)20-25-19-14/h2-8H,9-10H2,1H3,(H,18,21)