methyl 3-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]sulfanylpropanoate CAS Name: 3-[[(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]sulfanylpropanoate Traditional Name: 3-[[(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl]thio]propionic acid methyl ester Formula: C17H24N2O5S2 MolecularWeight: 400.51286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SCCC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SCCC(=O)OC

InChI

InChI=1S/C17H24N2O5S2/c1-13(25-12-9-16(20)24-2)17(21)18-14-5-7-15(8-6-14)26(22,23)19-10-3-4-11-19/h5-8,13H,3-4,9-12H2,1-2H3,(H,18,21)/t13-/m1/s1