(2R,3R)-2-(4-methylsulfanylphenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: (2R,3R)-2-(4-methylsulfanylphenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: (2R,3R)-1-benzyl-2-(4-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (2R,3R)-2-[4-(methylthio)phenyl]-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylate IUPAC Name: (2R,3R)-1-benzyl-2-(4-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (2R,3R)-1-benzyl-5-keto-2-[4-(methylthio)phenyl]pyrrolidine-3-carboxylate Formula: C19H18NO3S- MolecularWeight: 340.41612

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2C(CC(=O)N2CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)[C@H]2[C@@H](CC(=O)N2CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C19H19NO3S/c1-24-15-9-7-14(8-10-15)18-16(19(22)23)11-17(21)20(18)12-13-5-3-2-4-6-13/h2-10,16,18H,11-12H2,1H3,(H,22,23)/p-1/t16-,18+/m1/s1