dimethyl (2R,3S)-2-benzamido-3-ethanoylsulfanyl-butanedioate

Systemtic Name: dimethyl (2R,3S)-2-benzamido-3-ethanoylsulfanyl-butanedioate Openeye Name: dimethyl (2S,3R)-2-acetylsulfanyl-3-benzamido-butanedioate CAS Name: (2S,3R)-2-(acetylthio)-3-benzamidobutanedioic acid dimethyl ester IUPAC Name: dimethyl (2S,3R)-2-acetylsulfanyl-3-benzamidobutanedioate Traditional Name: (2S,3R)-2-(acetylthio)-3-benzamido-succinic acid dimethyl ester Formula: C15H17NO6S MolecularWeight: 339.36358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C(C(=O)OC)NC(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(=O)S[C@@H]([C@@H](C(=O)OC)NC(=O)C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C15H17NO6S/c1-9(17)23-12(15(20)22-3)11(14(19)21-2)16-13(18)10-7-5-4-6-8-10/h4-8,11-12H,1-3H3,(H,16,18)/t11-,12-/m0/s1