methyl (2S)-3-phenyl-2-(2-sulfanylethanoylamino)propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-(2-sulfanylethanoylamino)propanoate Openeye Name: methyl (2S)-3-phenyl-2-[(2-sulfanylacetyl)amino]propanoate CAS Name: (2S)-2-[(2-mercapto-1-oxoethyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[(2-sulfanylacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-mercaptoacetyl)amino]-3-phenyl-propionic acid methyl ester Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CS

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CS

InChI

InChI=1S/C12H15NO3S/c1-16-12(15)10(13-11(14)8-17)7-9-5-3-2-4-6-9/h2-6,10,17H,7-8H2,1H3,(H,13,14)/t10-/m0/s1