2-(2-methoxyethoxy)-9-(phenylmethyl)-N8-(2-piperidin-1-ylethyl)purine-6,8-diamine

Systemtic Name: 2-(2-methoxyethoxy)-9-(phenylmethyl)-N8-(2-piperidin-1-ylethyl)purine-6,8-diamine Openeye Name: 9-benzyl-2-(2-methoxyethoxy)-N8-[2-(1-piperidyl)ethyl]purine-6,8-diamine CAS Name: 2-(2-methoxyethoxy)-9-(phenylmethyl)-N8-[2-(1-piperidinyl)ethyl]purine-6,8-diamine IUPAC Name: 9-benzyl-2-(2-methoxyethoxy)-8-N-(2-piperidin-1-ylethyl)purine-6,8-diamine Traditional Name: [6-amino-9-benzyl-2-(2-methoxyethoxy)purin-8-yl]-(2-piperidinoethyl)amine Formula: C22H31N7O2 MolecularWeight: 425.52724

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=CC=C3)NCCN4CCCCC4

Isomeric SMILES

COCCOC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=CC=C3)NCCN4CCCCC4

InChI

InChI=1S/C22H31N7O2/c1-30-14-15-31-22-26-19(23)18-20(27-22)29(16-17-8-4-2-5-9-17)21(25-18)24-10-13-28-11-6-3-7-12-28/h2,4-5,8-9H,3,6-7,10-16H2,1H3,(H,24,25)(H2,23,26,27)