6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine

Systemtic Name: 6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine Openeye Name: 6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine CAS Name: 6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine IUPAC Name: 6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine Traditional Name: 6-ethyl-9-(4-methoxyphenyl)-2-(trifluoromethyl)purine Formula: C15H13F3N4O MolecularWeight: 322.28513

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C15H13F3N4O/c1-3-11-12-13(21-14(20-11)15(16,17)18)22(8-19-12)9-4-6-10(23-2)7-5-9/h4-8H,3H2,1-2H3