[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-ethylbenzoate

Systemtic Name: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-ethylbenzoate Openeye Name: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylanilino)-2-oxoethyl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C18H19NO3S/c1-3-13-8-10-14(11-9-13)18(21)22-12-17(20)19-15-6-4-5-7-16(15)23-2/h4-11H,3,12H2,1-2H3,(H,19,20)