N2-(4-azanylcyclohexyl)-9-ethyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-ethyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-ethyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-ethyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-ethyl-6-N-[(4-phenylphenyl)methyl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-ethyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amine Formula: C26H31N7 MolecularWeight: 441.57124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N

InChI

InChI=1S/C26H31N7/c1-2-33-17-29-23-24(31-26(32-25(23)33)30-22-14-12-21(27)13-15-22)28-16-18-8-10-20(11-9-18)19-6-4-3-5-7-19/h3-11,17,21-22H,2,12-16,27H2,1H3,(H2,28,30,31,32)