9-[(3-bromophenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: 9-[(3-bromophenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Openeye Name: 9-[(3-bromophenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine CAS Name: 9-[(3-bromophenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)-6-purinamine IUPAC Name: 9-[(3-bromophenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(3-bromobenzyl)-2-(trifluoromethyl)purin-6-yl]-dimethyl-amine Formula: C15H13BrF3N5 MolecularWeight: 400.19643

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2CC3=CC(=CC=C3)Br)C(F)(F)F

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2CC3=CC(=CC=C3)Br)C(F)(F)F

InChI

InChI=1S/C15H13BrF3N5/c1-23(2)12-11-13(22-14(21-12)15(17,18)19)24(8-20-11)7-9-4-3-5-10(16)6-9/h3-6,8H,7H2,1-2H3