[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CSC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CSC=C2

InChI

InChI=1S/C16H17NO3S2/c1-12-2-4-14(5-3-12)22-9-7-17-15(18)10-20-16(19)13-6-8-21-11-13/h2-6,8,11H,7,9-10H2,1H3,(H,17,18)