(4-methoxyphenyl)methyl (2S,4S)-2-[[(2-methoxy-2-oxidanylidene-ethyl)sulfonylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (2S,4S)-2-[[(2-methoxy-2-oxidanylidene-ethyl)sulfonylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-methoxyphenyl)methyl (2S,4S)-2-[[(2-methoxy-2-oxo-ethyl)sulfonylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-4-mercapto-2-[[(2-methoxy-2-oxoethyl)sulfonylamino]methyl]-1-pyrrolidinecarboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (2S,4S)-2-[[(2-methoxy-2-oxoethyl)sulfonylamino]methyl]-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[[(2-keto-2-methoxy-ethyl)sulfonylamino]methyl]-4-mercapto-pyrrolidine-1-carboxylic acid p-anisyl ester Formula: C17H24N2O7S2 MolecularWeight: 432.51166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)N2CC(CC2CNS(=O)(=O)CC(=O)OC)S

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)N2C[C@H](C[C@H]2CNS(=O)(=O)CC(=O)OC)S

InChI

InChI=1S/C17H24N2O7S2/c1-24-14-5-3-12(4-6-14)10-26-17(21)19-9-15(27)7-13(19)8-18-28(22,23)11-16(20)25-2/h3-6,13,15,18,27H,7-11H2,1-2H3/t13-,15-/m0/s1