(4-ethanoylphenyl) 2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (4-ethanoylphenyl) 2-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (4-acetylphenyl) 2-[2-(2,4-dimethylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,4-dimethylanilino)-2-oxoethyl]thio]acetic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,4-dimethylanilino)-2-keto-ethyl]thio]acetic acid (4-acetylphenyl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)OC2=CC=C(C=C2)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC(=O)OC2=CC=C(C=C2)C(=O)C)C

InChI

InChI=1S/C20H21NO4S/c1-13-4-9-18(14(2)10-13)21-19(23)11-26-12-20(24)25-17-7-5-16(6-8-17)15(3)22/h4-10H,11-12H2,1-3H3,(H,21,23)