9-[(4-chloranyl-2-methyl-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: 9-[(4-chloranyl-2-methyl-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Openeye Name: 9-[(4-chloro-2-methyl-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine CAS Name: 9-[(4-chloro-2-methylphenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)-6-purinamine IUPAC Name: 9-[(4-chloro-2-methylphenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(4-chloro-2-methyl-benzyl)-2-(trifluoromethyl)purin-6-yl]-dimethyl-amine Formula: C16H15ClF3N5 MolecularWeight: 369.77201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)CN2C=NC3=C2N=C(N=C3N(C)C)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)CN2C=NC3=C2N=C(N=C3N(C)C)C(F)(F)F

InChI

InChI=1S/C16H15ClF3N5/c1-9-6-11(17)5-4-10(9)7-25-8-21-12-13(24(2)3)22-15(16(18,19)20)23-14(12)25/h4-6,8H,7H2,1-3H3