[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C17H24N2O4S/c1-12(2)8-9-18-17(22)19-15(20)10-23-16(21)11-24-14-7-5-4-6-13(14)3/h4-7,12H,8-11H2,1-3H3,(H2,18,19,20,22)