5-methyl-1-phenyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-phenyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pyrazole-4-carboxamide Openeye Name: 5-methyl-1-phenyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]pyrazole-4-carboxamide CAS Name: 5-methyl-1-phenyl-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-1-phenyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pyrazole-4-carboxamide Traditional Name: 5-methyl-1-phenyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]pyrazole-4-carboxamide Formula: C23H19F3N4OS MolecularWeight: 456.48337

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCSC3=CC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCSC3=CC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C23H19F3N4OS/c1-15-18(14-28-30(15)16-7-3-2-4-8-16)22(31)27-11-12-32-20-13-21(23(24,25)26)29-19-10-6-5-9-17(19)20/h2-10,13-14H,11-12H2,1H3,(H,27,31)