N2-(4-azanylcyclohexyl)-N6-(phenylmethyl)-9-propyl-purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-(phenylmethyl)-9-propyl-purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-benzyl-9-propyl-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-(phenylmethyl)-9-propylpurine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-benzyl-9-propylpurine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-(benzylamino)-9-propyl-purin-2-yl]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)NC4CCC(CC4)N

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NC4CCC(CC4)N

InChI

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