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

Systemtic Name: N2-(1-ethylpiperidin-3-yl)-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Openeye Name: N2-(1-ethyl-3-piperidyl)-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine CAS Name: N2-(1-ethyl-3-piperidinyl)-N4-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine IUPAC Name: 2-N-(1-ethylpiperidin-3-yl)-4-N-[4-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Traditional Name: (1-ethyl-3-piperidyl)-[4-[4-(trifluoromethyl)anilino]quinazolin-2-yl]amine Formula: C22H24F3N5 MolecularWeight: 415.45467

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)NC2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCN1CCCC(C1)NC2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H24F3N5/c1-2-30-13-5-6-17(14-30)27-21-28-19-8-4-3-7-18(19)20(29-21)26-16-11-9-15(10-12-16)22(23,24)25/h3-4,7-12,17H,2,5-6,13-14H2,1H3,(H2,26,27,28,29)