9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoranyl-4-methoxy-2-methyl-phenyl)purine

Systemtic Name: 9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoranyl-4-methoxy-2-methyl-phenyl)purine Openeye Name: 9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoro-4-methoxy-2-methyl-phenyl)purine CAS Name: 9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoro-4-methoxy-2-methylphenyl)purine IUPAC Name: 9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoro-4-methoxy-2-methylphenyl)purine Traditional Name: 9-(dicyclopropylmethyl)-8-ethyl-6-(5-fluoro-4-methoxy-2-methyl-phenyl)purine Formula: C22H25FN4O MolecularWeight: 380.458503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N=CN=C2N1C(C3CC3)C4CC4)C5=CC(=C(C=C5C)OC)F

Isomeric SMILES

CCC1=NC2=C(N=CN=C2N1C(C3CC3)C4CC4)C5=CC(=C(C=C5C)OC)F

InChI

InChI=1S/C22H25FN4O/c1-4-18-26-20-19(15-10-16(23)17(28-3)9-12(15)2)24-11-25-22(20)27(18)21(13-5-6-13)14-7-8-14/h9-11,13-14,21H,4-8H2,1-3H3