[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C20H22N2O4S/c1-14-8-9-17(15(2)10-14)27-13-19(24)26-12-18(23)22-20(25)21-11-16-6-4-3-5-7-16/h3-10H,11-13H2,1-2H3,(H2,21,22,23,25)