8-(4-azanylcyclohexyl)-N6-(phenylmethyl)-9-propyl-purine-2,6-diamine

Systemtic Name: 8-(4-azanylcyclohexyl)-N6-(phenylmethyl)-9-propyl-purine-2,6-diamine Openeye Name: 8-(4-aminocyclohexyl)-N6-benzyl-9-propyl-purine-2,6-diamine CAS Name: 8-(4-aminocyclohexyl)-N6-(phenylmethyl)-9-propylpurine-2,6-diamine IUPAC Name: 8-(4-aminocyclohexyl)-6-N-benzyl-9-propylpurine-2,6-diamine Traditional Name: [2-amino-8-(4-aminocyclohexyl)-9-propyl-purin-6-yl]-benzyl-amine Formula: C21H29N7 MolecularWeight: 379.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NC2=C1N=C(N=C2NCC3=CC=CC=C3)N)C4CCC(CC4)N

Isomeric SMILES

CCCN1C(=NC2=C1N=C(N=C2NCC3=CC=CC=C3)N)C4CCC(CC4)N

InChI

InChI=1S/C21H29N7/c1-2-12-28-19(15-8-10-16(22)11-9-15)25-17-18(26-21(23)27-20(17)28)24-13-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13,22H2,1H3,(H3,23,24,26,27)