2-methyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]pyrazole-3-carboxamide

Systemtic Name: 2-methyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]pyrazole-3-carboxamide Openeye Name: 2-methyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]pyrazole-3-carboxamide CAS Name: 2-methyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]-2-quinazolinyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 2-methyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]pyrazole-3-carboxamide Traditional Name: 2-methyl-N-[[4-[[3-(trifluoromethyl)benzyl]amino]quinazolin-2-yl]methyl]pyrazole-3-carboxamide Formula: C22H19F3N6O MolecularWeight: 440.42107

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CN1C(=CC=N1)C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H19F3N6O/c1-31-18(9-10-28-31)21(32)27-13-19-29-17-8-3-2-7-16(17)20(30-19)26-12-14-5-4-6-15(11-14)22(23,24)25/h2-11H,12-13H2,1H3,(H,27,32)(H,26,29,30)