9-[(4-chloranyl-3-methoxy-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine

Systemtic Name: 9-[(4-chloranyl-3-methoxy-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Openeye Name: 9-[(4-chloro-3-methoxy-phenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine CAS Name: 9-[(4-chloro-3-methoxyphenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)-6-purinamine IUPAC Name: 9-[(4-chloro-3-methoxyphenyl)methyl]-N,N-dimethyl-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(4-chloro-3-methoxy-benzyl)-2-(trifluoromethyl)purin-6-yl]-dimethyl-amine Formula: C16H15ClF3N5O MolecularWeight: 385.77141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClF3N5O/c1-24(2)13-12-14(23-15(22-13)16(18,19)20)25(8-21-12)7-9-4-5-10(17)11(6-9)26-3/h4-6,8H,7H2,1-3H3