[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 2-phenylsulfanylethanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 2-phenylsulfanylethanoate Openeye Name: [(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)OC(=O)CSC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)OC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C14H19NO3S/c1-10(2)15-14(17)11(3)18-13(16)9-19-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3,(H,15,17)/t11-/m0/s1