N-methyl-N-(phenylmethyl)-2-(trifluoromethyl)-7H-purin-6-amine

Systemtic Name: N-methyl-N-(phenylmethyl)-2-(trifluoromethyl)-7H-purin-6-amine Openeye Name: N-benzyl-N-methyl-2-(trifluoromethyl)-7H-purin-6-amine CAS Name: N-methyl-N-(phenylmethyl)-2-(trifluoromethyl)-7H-purin-6-amine IUPAC Name: N-benzyl-N-methyl-2-(trifluoromethyl)-7H-purin-6-amine Traditional Name: benzyl-methyl-[2-(trifluoromethyl)-7H-purin-6-yl]amine Formula: C14H12F3N5 MolecularWeight: 307.27379

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC(=NC3=C2NC=N3)C(F)(F)F

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC(=NC3=C2NC=N3)C(F)(F)F

InChI

InChI=1S/C14H12F3N5/c1-22(7-9-5-3-2-4-6-9)12-10-11(19-8-18-10)20-13(21-12)14(15,16)17/h2-6,8H,7H2,1H3,(H,18,19,20,21)