N-(4-methylsulfanylphenyl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(4-methylsulfanylphenyl)pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[4-(methylthio)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(4-methylsulfanylphenyl)pyrrolidine-2-carboxamide Traditional Name: 1-besyl-N-[4-(methylthio)phenyl]pyrrolidine-2-carboxamide Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O3S2/c1-24-15-11-9-14(10-12-15)19-18(21)17-8-5-13-20(17)25(22,23)16-6-3-2-4-7-16/h2-4,6-7,9-12,17H,5,8,13H2,1H3,(H,19,21)