6-ethyl-9-[(3-methoxyphenyl)methyl]-2-(trifluoromethyl)purine

Systemtic Name: 6-ethyl-9-[(3-methoxyphenyl)methyl]-2-(trifluoromethyl)purine Openeye Name: 6-ethyl-9-[(3-methoxyphenyl)methyl]-2-(trifluoromethyl)purine CAS Name: 6-ethyl-9-[(3-methoxyphenyl)methyl]-2-(trifluoromethyl)purine IUPAC Name: 6-ethyl-9-[(3-methoxyphenyl)methyl]-2-(trifluoromethyl)purine Traditional Name: 6-ethyl-9-m-anisyl-2-(trifluoromethyl)purine Formula: C16H15F3N4O MolecularWeight: 336.31171

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCC1=C2C(=NC(=N1)C(F)(F)F)N(C=N2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C16H15F3N4O/c1-3-12-13-14(22-15(21-12)16(17,18)19)23(9-20-13)8-10-5-4-6-11(7-10)24-2/h4-7,9H,3,8H2,1-2H3