N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C22H24F3N5O MolecularWeight: 431.45407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCNC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCNC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C22H24F3N5O/c1-31-19-9-5-4-8-18(19)30-14-12-29(13-15-30)11-10-26-20-16-6-2-3-7-17(16)27-21(28-20)22(23,24)25/h2-9H,10-15H2,1H3,(H,26,27,28)