[(2R)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-phenylsulfanylpropanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-phenylsulfanylpropanoate Openeye Name: [(1R)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [(2R)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [(1R)-2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

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

InChI

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