N-(3-methylbutyl)-2-[[3-(trifluoromethyl)phenyl]amino]quinoline-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-[[3-(trifluoromethyl)phenyl]amino]quinoline-4-carboxamide Openeye Name: N-isopentyl-2-[3-(trifluoromethyl)anilino]quinoline-4-carboxamide CAS Name: N-(3-methylbutyl)-2-[3-(trifluoromethyl)anilino]-4-quinolinecarboxamide IUPAC Name: N-(3-methylbutyl)-2-[3-(trifluoromethyl)anilino]quinoline-4-carboxamide Traditional Name: N-isoamyl-2-[3-(trifluoromethyl)anilino]cinchoninamide Formula: C22H22F3N3O MolecularWeight: 401.42479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O/c1-14(2)10-11-26-21(29)18-13-20(28-19-9-4-3-8-17(18)19)27-16-7-5-6-15(12-16)22(23,24)25/h3-9,12-14H,10-11H2,1-2H3,(H,26,29)(H,27,28)