9-cyclohexyl-N8-(2-fluorophenyl)-N2-(4-methoxyphenyl)purine-2,8-diamine

Systemtic Name: 9-cyclohexyl-N8-(2-fluorophenyl)-N2-(4-methoxyphenyl)purine-2,8-diamine Openeye Name: 9-cyclohexyl-N8-(2-fluorophenyl)-N2-(4-methoxyphenyl)purine-2,8-diamine CAS Name: 9-cyclohexyl-N8-(2-fluorophenyl)-N2-(4-methoxyphenyl)purine-2,8-diamine IUPAC Name: 9-cyclohexyl-8-N-(2-fluorophenyl)-2-N-(4-methoxyphenyl)purine-2,8-diamine Traditional Name: [9-cyclohexyl-8-(2-fluoroanilino)purin-2-yl]-(4-methoxyphenyl)amine Formula: C24H25FN6O MolecularWeight: 432.493303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)NC4=CC=CC=C4F)C5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)NC4=CC=CC=C4F)C5CCCCC5

InChI

InChI=1S/C24H25FN6O/c1-32-18-13-11-16(12-14-18)27-23-26-15-21-22(30-23)31(17-7-3-2-4-8-17)24(29-21)28-20-10-6-5-9-19(20)25/h5-6,9-15,17H,2-4,7-8H2,1H3,(H,28,29)(H,26,27,30)