N-(phenylmethyl)-N-(trifluoromethyl)-7H-purin-8-amine

Systemtic Name: N-(phenylmethyl)-N-(trifluoromethyl)-7H-purin-8-amine Openeye Name: N-benzyl-N-(trifluoromethyl)-7H-purin-8-amine CAS Name: N-(phenylmethyl)-N-(trifluoromethyl)-7H-purin-8-amine IUPAC Name: N-benzyl-N-(trifluoromethyl)-7H-purin-8-amine Traditional Name: benzyl-(7H-purin-8-yl)-(trifluoromethyl)amine Formula: C13H10F3N5 MolecularWeight: 293.24721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=NC3=NC=NC=C3N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=NC3=NC=NC=C3N2)C(F)(F)F

InChI

InChI=1S/C13H10F3N5/c14-13(15,16)21(7-9-4-2-1-3-5-9)12-19-10-6-17-8-18-11(10)20-12/h1-6,8H,7H2,(H,17,18,19,20)