4-(4-fluorophenyl)-N-(3-methylbutyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide

Systemtic Name: 4-(4-fluorophenyl)-N-(3-methylbutyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)-N-isopentyl-pyrrolidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)-N-(3-methylbutyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-4-(4-fluorophenyl)-N-(3-methylbutyl)pyrrolidine-3-carboxamide Traditional Name: 1-besyl-4-(4-fluorophenyl)-N-isoamyl-pyrrolidine-3-carboxamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CN(CC1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1CN(CC1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27FN2O3S/c1-16(2)12-13-24-22(26)21-15-25(29(27,28)19-6-4-3-5-7-19)14-20(21)17-8-10-18(23)11-9-17/h3-11,16,20-21H,12-15H2,1-2H3,(H,24,26)