[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)COC(=O)CCSC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O4S/c1-3-12(2)17-16(21)18-14(19)11-22-15(20)9-10-23-13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3,(H2,17,18,19,21)/t12-/m1/s1