(2S)-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylpropanoic acid Openeye Name: (2S)-2-(2-anilino-2-oxo-ethyl)sulfanylpropanoic acid CAS Name: (2S)-2-[(2-anilino-2-oxoethyl)thio]propanoic acid IUPAC Name: (2S)-2-(2-anilino-2-oxoethyl)sulfanylpropanoic acid Traditional Name: (2S)-2-[(2-anilino-2-keto-ethyl)thio]propionic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3S/c1-8(11(14)15)16-7-10(13)12-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)(H,14,15)/t8-/m0/s1