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

Systemtic Name: 8-bromanyl-N-methyl-N-(phenylmethyl)-2-(trifluoromethyl)-7H-purin-6-amine Openeye Name: N-benzyl-8-bromo-N-methyl-2-(trifluoromethyl)-7H-purin-6-amine CAS Name: 8-bromo-N-methyl-N-(phenylmethyl)-2-(trifluoromethyl)-7H-purin-6-amine IUPAC Name: N-benzyl-8-bromo-N-methyl-2-(trifluoromethyl)-7H-purin-6-amine Traditional Name: benzyl-[8-bromo-2-(trifluoromethyl)-7H-purin-6-yl]-methyl-amine Formula: C14H11BrF3N5 MolecularWeight: 386.16985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrF3N5/c1-23(7-8-5-3-2-4-6-8)11-9-10(21-13(15)19-9)20-12(22-11)14(16,17)18/h2-6H,7H2,1H3,(H,19,20,21,22)