N4-[6-[2-(2-chlorophenyl)hydrazinyl]-9-cyclopentyl-purin-8-yl]cyclohexane-1,4-diamine

Systemtic Name: N4-[6-[2-(2-chlorophenyl)hydrazinyl]-9-cyclopentyl-purin-8-yl]cyclohexane-1,4-diamine Openeye Name: N4-[6-[2-(2-chlorophenyl)hydrazino]-9-cyclopentyl-purin-8-yl]cyclohexane-1,4-diamine CAS Name: N4-[6-[(2-chlorophenyl)hydrazo]-9-cyclopentyl-8-purinyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[6-[2-(2-chlorophenyl)hydrazinyl]-9-cyclopentylpurin-8-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[6-[N'-(2-chlorophenyl)hydrazino]-9-cyclopentyl-purin-8-yl]amine Formula: C22H29ClN8 MolecularWeight: 440.97226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=NC=N3)NNC4=CC=CC=C4Cl)N=C2NC5CCC(CC5)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=NC=N3)NNC4=CC=CC=C4Cl)N=C2NC5CCC(CC5)N

InChI

InChI=1S/C22H29ClN8/c23-17-7-3-4-8-18(17)29-30-20-19-21(26-13-25-20)31(16-5-1-2-6-16)22(28-19)27-15-11-9-14(24)10-12-15/h3-4,7-8,13-16,29H,1-2,5-6,9-12,24H2,(H,27,28)(H,25,26,30)