(2S)-2-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanylpropanoate

Systemtic Name: (2S)-2-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanylpropanoate Openeye Name: (2S)-2-[(1R)-2-anilino-1-methyl-2-oxo-ethyl]sulfanylpropanoate CAS Name: (2S)-2-[[(2R)-1-anilino-1-oxopropan-2-yl]thio]propanoate IUPAC Name: (2S)-2-[(2R)-1-anilino-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: (2S)-2-[[(1R)-2-anilino-2-keto-1-methyl-ethyl]thio]propionate Formula: C12H14NO3S- MolecularWeight: 252.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC(C)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)S[C@@H](C)C(=O)[O-]

InChI

InChI=1S/C12H15NO3S/c1-8(17-9(2)12(15)16)11(14)13-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,13,14)(H,15,16)/p-1/t8-,9+/m1/s1