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

Systemtic Name: N4-[6-(2-chloranyl-2-phenyl-hydrazinyl)-9-cyclopentyl-purin-8-yl]cyclohexane-1,4-diamine Openeye Name: N4-[6-(2-chloro-2-phenyl-hydrazino)-9-cyclopentyl-purin-8-yl]cyclohexane-1,4-diamine CAS Name: N4-[6-(2-chloro-2-phenylhydrazinyl)-9-cyclopentyl-8-purinyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[6-(2-chloro-2-phenylhydrazinyl)-9-cyclopentylpurin-8-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[6-(N'-chloro-N'-phenyl-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)NN(C4=CC=CC=C4)Cl)N=C2NC5CCC(CC5)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=NC=N3)NN(C4=CC=CC=C4)Cl)N=C2NC5CCC(CC5)N

InChI

InChI=1S/C22H29ClN8/c23-31(18-8-2-1-3-9-18)29-20-19-21(26-14-25-20)30(17-6-4-5-7-17)22(28-19)27-16-12-10-15(24)11-13-16/h1-3,8-9,14-17H,4-7,10-13,24H2,(H,27,28)(H,25,26,29)