N-methyl-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-6-amine

Systemtic Name: N-methyl-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-6-amine Openeye Name: N-methyl-2-[4-[2-(trifluoromethyl)phenoxy]-1-piperidyl]-7H-purin-6-amine CAS Name: N-methyl-2-[4-[2-(trifluoromethyl)phenoxy]-1-piperidinyl]-7H-purin-6-amine IUPAC Name: N-methyl-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-7H-purin-6-amine Traditional Name: methyl-[2-[4-[2-(trifluoromethyl)phenoxy]piperidino]-7H-purin-6-yl]amine Formula: C18H19F3N6O MolecularWeight: 392.37827

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1NC=N2)N3CCC(CC3)OC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CNC1=NC(=NC2=C1NC=N2)N3CCC(CC3)OC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C18H19F3N6O/c1-22-15-14-16(24-10-23-14)26-17(25-15)27-8-6-11(7-9-27)28-13-5-3-2-4-12(13)18(19,20)21/h2-5,10-11H,6-9H2,1H3,(H2,22,23,24,25,26)