dimethyl (2S,3S)-2-azanyl-3-(phenylmethylsulfanyl)butanedioate

Systemtic Name: dimethyl (2S,3S)-2-azanyl-3-(phenylmethylsulfanyl)butanedioate Openeye Name: dimethyl (2S,3S)-2-amino-3-benzylsulfanyl-butanedioate CAS Name: (2S,3S)-2-amino-3-(phenylmethylthio)butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S,3S)-2-amino-3-benzylsulfanylbutanedioate Traditional Name: (2S,3S)-2-amino-3-(benzylthio)succinic acid dimethyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C(=O)OC)SCC1=CC=CC=C1)N

Isomeric SMILES

COC(=O)[C@@H]([C@@H](C(=O)OC)SCC1=CC=CC=C1)N

InChI

InChI=1S/C13H17NO4S/c1-17-12(15)10(14)11(13(16)18-2)19-8-9-6-4-3-5-7-9/h3-7,10-11H,8,14H2,1-2H3/t10-,11+/m1/s1