N-methyl-N-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperidin-4-yl]methyl]-7H-purin-6-amine

Systemtic Name: N-methyl-N-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperidin-4-yl]methyl]-7H-purin-6-amine Openeye Name: N-methyl-N-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-4-piperidyl]methyl]-7H-purin-6-amine CAS Name: N-methyl-N-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-4-piperidinyl]methyl]-7H-purin-6-amine IUPAC Name: N-methyl-N-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperidin-4-yl]methyl]-7H-purin-6-amine Traditional Name: methyl-(7H-purin-6-yl)-[[1-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-4-piperidyl]methyl]amine Formula: C21H21F3N8 MolecularWeight: 442.44025

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCN(CC1)C2=NC=CC3=C2C=CC(=N3)C(F)(F)F)C4=NC=NC5=C4NC=N5

Isomeric SMILES

CN(CC1CCN(CC1)C2=NC=CC3=C2C=CC(=N3)C(F)(F)F)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C21H21F3N8/c1-31(20-17-18(27-11-26-17)28-12-29-20)10-13-5-8-32(9-6-13)19-14-2-3-16(21(22,23)24)30-15(14)4-7-25-19/h2-4,7,11-13H,5-6,8-10H2,1H3,(H,26,27,28,29)