2-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[4-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[4-[4-(trifluoromethyl)benzyl]piperazino]methyl]quinazolin-4-yl]amine Formula: C21H22F3N5 MolecularWeight: 401.42809

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(F)(F)F)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(F)(F)F)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C21H22F3N5/c22-21(23,24)16-7-5-15(6-8-16)13-28-9-11-29(12-10-28)14-19-26-18-4-2-1-3-17(18)20(25)27-19/h1-8H,9-14H2,(H2,25,26,27)