N2-(3-piperidin-1-ylpropyl)-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine

Systemtic Name: N2-(3-piperidin-1-ylpropyl)-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Openeye Name: N2-[3-(1-piperidyl)propyl]-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine CAS Name: N2-[3-(1-piperidinyl)propyl]-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine IUPAC Name: 2-N-(3-piperidin-1-ylpropyl)-4-N-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Traditional Name: 3-piperidinopropyl-[4-[4-(trifluoromethyl)anilino]quinazolin-2-yl]amine Formula: C23H26F3N5 MolecularWeight: 429.48125

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)CCCNC2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H26F3N5/c24-23(25,26)17-9-11-18(12-10-17)28-21-19-7-2-3-8-20(19)29-22(30-21)27-13-6-16-31-14-4-1-5-15-31/h2-3,7-12H,1,4-6,13-16H2,(H2,27,28,29,30)