N2-(4-azanylcyclohexyl)-N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-[(4-fluorobenzyl)amino]-7H-purin-2-yl]amine Formula: C18H22FN7 MolecularWeight: 355.412583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC3=C(C(=N2)NCC4=CC=C(C=C4)F)NC=N3

Isomeric SMILES

C1CC(CCC1N)NC2=NC3=C(C(=N2)NCC4=CC=C(C=C4)F)NC=N3

InChI

InChI=1S/C18H22FN7/c19-12-3-1-11(2-4-12)9-21-16-15-17(23-10-22-15)26-18(25-16)24-14-7-5-13(20)6-8-14/h1-4,10,13-14H,5-9,20H2,(H3,21,22,23,24,25,26)