N2-(4-azanylcyclohexyl)-N6-[2-[(phenylmethyl)amino]ethyl]-7H-purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-[2-[(phenylmethyl)amino]ethyl]-7H-purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-[2-(benzylamino)ethyl]-7H-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-[2-[(phenylmethyl)amino]ethyl]-7H-purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-[2-(benzylamino)ethyl]-7H-purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-[2-(benzylamino)ethylamino]-7H-purin-2-yl]amine Formula: C20H28N8 MolecularWeight: 380.48992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC3=C(C(=N2)NCCNCC4=CC=CC=C4)NC=N3

Isomeric SMILES

C1CC(CCC1N)NC2=NC3=C(C(=N2)NCCNCC4=CC=CC=C4)NC=N3

InChI

InChI=1S/C20H28N8/c21-15-6-8-16(9-7-15)26-20-27-18(17-19(28-20)25-13-24-17)23-11-10-22-12-14-4-2-1-3-5-14/h1-5,13,15-16,22H,6-12,21H2,(H3,23,24,25,26,27,28)