1-(4-fluorophenyl)sulfonyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(p-tolylmethylsulfanyl)ethyl]pyrrolidine-2-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[2-[(4-methylphenyl)methylthio]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[2-[(4-methylbenzyl)thio]ethyl]pyrrolidine-2-carboxamide Formula: C21H25FN2O3S2 MolecularWeight: 436.563203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O3S2/c1-16-4-6-17(7-5-16)15-28-14-12-23-21(25)20-3-2-13-24(20)29(26,27)19-10-8-18(22)9-11-19/h4-11,20H,2-3,12-15H2,1H3,(H,23,25)