[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)sulfanylethanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 2-(4-chlorophenyl)sulfanylacetate CAS Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 2-(4-chlorophenyl)sulfanylacetate Traditional Name: 2-[(4-chlorophenyl)thio]acetic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CSC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C18H18ClNO3S/c1-12-7-13(2)9-15(8-12)20-17(21)10-23-18(22)11-24-16-5-3-14(19)4-6-16/h3-9H,10-11H2,1-2H3,(H,20,21)