[2-oxidanylidene-2-(phenethylamino)ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)OCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO3S/c1-15-8-9-16(2)18(12-15)25-14-20(23)24-13-19(22)21-11-10-17-6-4-3-5-7-17/h3-9,12H,10-11,13-14H2,1-2H3,(H,21,22)