N-(3-methyl-2-phenyl-butyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: N-(3-methyl-2-phenyl-butyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: N-(3-methyl-2-phenyl-butyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: N-(3-methyl-2-phenylbutyl)-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: N-(3-methyl-2-phenylbutyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: (3-methyl-2-phenyl-butyl)-[7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amine Formula: C25H23F3N4 MolecularWeight: 436.47213

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1=NC=NC2=C1C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CNC1=NC=NC2=C1C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C25H23F3N4/c1-16(2)20(17-7-4-3-5-8-17)14-30-24-19-11-10-18(13-22(19)31-15-32-24)23-21(25(26,27)28)9-6-12-29-23/h3-13,15-16,20H,14H2,1-2H3,(H,30,31,32)