1-quinolin-8-ylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-quinolin-8-ylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-(8-quinolylsulfonyl)-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-(8-quinolinylsulfonyl)-N-[3-(trifluoromethyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-quinolin-8-ylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(8-quinolylsulfonyl)-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide Formula: C21H18F3N3O3S MolecularWeight: 449.44613

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3S/c22-21(23,24)15-7-2-8-16(13-15)26-20(28)17-9-4-12-27(17)31(29,30)18-10-1-5-14-6-3-11-25-19(14)18/h1-3,5-8,10-11,13,17H,4,9,12H2,(H,26,28)