(2R)-2-azanyl-3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-amino-3-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: (2R)-2-amino-3-[[2-(4-methylanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: (2R)-2-amino-3-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: (2R)-2-amino-3-[[2-keto-2-(p-toluidino)ethyl]thio]propionic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC[C@@H](C(=O)O)N

InChI

InChI=1S/C12H16N2O3S/c1-8-2-4-9(5-3-8)14-11(15)7-18-6-10(13)12(16)17/h2-5,10H,6-7,13H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1