N6-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-N2-quinolin-6-yl-7H-purine-2,6-diamine

Systemtic Name: N6-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-N2-quinolin-6-yl-7H-purine-2,6-diamine Openeye Name: N6-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-N2-(6-quinolyl)-7H-purine-2,6-diamine CAS Name: N6-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-N2-(6-quinolinyl)-7H-purine-2,6-diamine IUPAC Name: 6-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-N-quinolin-6-yl-7H-purine-2,6-diamine Traditional Name: [2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-[2-(6-quinolylamino)-7H-purin-6-yl]amine Formula: C24H22FN7 MolecularWeight: 427.476783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)F)NC2=NC(=NC3=C2NC=N3)NC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)F)NC2=NC(=NC3=C2NC=N3)NC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C24H22FN7/c1-24(2,13-15-5-7-17(25)8-6-15)32-22-20-21(28-14-27-20)30-23(31-22)29-18-9-10-19-16(12-18)4-3-11-26-19/h3-12,14H,13H2,1-2H3,(H3,27,28,29,30,31,32)