N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine

Systemtic Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine Openeye Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine CAS Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]-4-quinazolinamine IUPAC Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinazolin-4-amine Traditional Name: (5-tert-butyl-1H-pyrazol-3-yl)-[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amine Formula: C22H20F3N5 MolecularWeight: 411.42291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H20F3N5/c1-21(2,3)17-12-18(30-29-17)27-20-14-9-5-7-11-16(14)26-19(28-20)13-8-4-6-10-15(13)22(23,24)25/h4-12H,1-3H3,(H2,26,27,28,29,30)