methyl (2R)-3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-[(phenylmethyl)amino]propanoate

Systemtic Name: methyl (2R)-3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-[(phenylmethyl)amino]propanoate Openeye Name: methyl (2R)-2-(benzylamino)-3-(2-methoxy-2-oxo-ethyl)sulfanyl-propanoate CAS Name: (2R)-3-[(2-methoxy-2-oxoethyl)thio]-2-[(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(benzylamino)-3-(2-methoxy-2-oxoethyl)sulfanylpropanoate Traditional Name: (2R)-2-(benzylamino)-3-[(2-keto-2-methoxy-ethyl)thio]propionic acid methyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC(C(=O)OC)NCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CSC[C@@H](C(=O)OC)NCC1=CC=CC=C1

InChI

InChI=1S/C14H19NO4S/c1-18-13(16)10-20-9-12(14(17)19-2)15-8-11-6-4-3-5-7-11/h3-7,12,15H,8-10H2,1-2H3/t12-/m0/s1