[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC=C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NC(=O)NCC=C)C

InChI

InChI=1S/C16H20N2O4S/c1-4-7-17-16(21)18-14(19)9-22-15(20)10-23-13-6-5-11(2)8-12(13)3/h4-6,8H,1,7,9-10H2,2-3H3,(H2,17,18,19,21)