ethyl (2R)-2-acetamido-3-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylsulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-acetamido-3-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylsulfanyl-propanoate Openeye Name: ethyl (2R)-2-acetamido-3-[(2S)-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]sulfanyl-propanoate CAS Name: (2R)-2-acetamido-3-[[[(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-acetamido-3-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]sulfanylpropanoate Traditional Name: (2R)-2-acetamido-3-[[(2S)-1-tosylprolyl]thio]propionic acid ethyl ester Formula: C19H26N2O6S2 MolecularWeight: 442.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)C

Isomeric SMILES

CCOC(=O)[C@H](CSC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)C

InChI

InChI=1S/C19H26N2O6S2/c1-4-27-18(23)16(20-14(3)22)12-28-19(24)17-6-5-11-21(17)29(25,26)15-9-7-13(2)8-10-15/h7-10,16-17H,4-6,11-12H2,1-3H3,(H,20,22)/t16-,17-/m0/s1