3-[[6-(dimethylamino)-2-(trifluoromethyl)purin-9-yl]methyl]phenol

Systemtic Name: 3-[[6-(dimethylamino)-2-(trifluoromethyl)purin-9-yl]methyl]phenol Openeye Name: 3-[[6-(dimethylamino)-2-(trifluoromethyl)purin-9-yl]methyl]phenol CAS Name: 3-[[6-(dimethylamino)-2-(trifluoromethyl)-9-purinyl]methyl]phenol IUPAC Name: 3-[[6-(dimethylamino)-2-(trifluoromethyl)purin-9-yl]methyl]phenol Traditional Name: 3-[[6-(dimethylamino)-2-(trifluoromethyl)purin-9-yl]methyl]phenol Formula: C15H14F3N5O MolecularWeight: 337.29977

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14F3N5O/c1-22(2)12-11-13(21-14(20-12)15(16,17)18)23(8-19-11)7-9-4-3-5-10(24)6-9/h3-6,8,24H,7H2,1-2H3