2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-[benzyl(methyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-[methyl-(phenylmethyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-[benzyl(methyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-[benzyl(methyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)N(C)CC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)O)SCC(=O)N(C)CC1=CC=CC=C1

InChI

InChI=1S/C13H17NO3S/c1-10(13(16)17)18-9-12(15)14(2)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,16,17)