N2-(4-azanylcyclohexyl)-N6-(4-chlorophenyl)-7H-purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-(4-chlorophenyl)-7H-purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-(4-chlorophenyl)-7H-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-(4-chlorophenyl)-7H-purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-(4-chlorophenyl)-7H-purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-(4-chloroanilino)-7H-purin-2-yl]amine Formula: C17H20ClN7 MolecularWeight: 357.8406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC3=C(C(=N2)NC4=CC=C(C=C4)Cl)NC=N3

Isomeric SMILES

C1CC(CCC1N)NC2=NC3=C(C(=N2)NC4=CC=C(C=C4)Cl)NC=N3

InChI

InChI=1S/C17H20ClN7/c18-10-1-5-12(6-2-10)22-16-14-15(21-9-20-14)24-17(25-16)23-13-7-3-11(19)4-8-13/h1-2,5-6,9,11,13H,3-4,7-8,19H2,(H3,20,21,22,23,24,25)