4-[2-(4-methylphenyl)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-[2-(4-methylphenyl)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[2-(p-tolyl)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[2-(4-methylphenyl)-4-quinazolinyl]-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[2-(4-methylphenyl)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-[2-(p-tolyl)quinazolin-4-yl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C27H24F3N5O MolecularWeight: 491.50757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C27H24F3N5O/c1-18-6-8-19(9-7-18)24-32-23-5-3-2-4-22(23)25(33-24)34-14-16-35(17-15-34)26(36)31-21-12-10-20(11-13-21)27(28,29)30/h2-13H,14-17H2,1H3,(H,31,36)