[2-oxidanylidene-2-(propan-2-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] (2S)-2-phenylsulfanylpropanoate CAS Name: (2S)-2-(phenylthio)propanoic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] (2S)-2-phenylsulfanylpropanoate Traditional Name: (2S)-2-(phenylthio)propionic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)C(C)SC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(C)C)SC1=CC=CC=C1

InChI

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