9-(furan-2-ylmethyl)-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]purin-8-amine

Systemtic Name: 9-(furan-2-ylmethyl)-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]purin-8-amine Openeye Name: 9-(2-furylmethyl)-N-[1-[2-(2-pyridyl)ethyl]-4-piperidyl]purin-8-amine CAS Name: 9-(2-furanylmethyl)-N-[1-[2-(2-pyridinyl)ethyl]-4-piperidinyl]-8-purinamine IUPAC Name: 9-(furan-2-ylmethyl)-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]purin-8-amine Traditional Name: [9-(2-furfuryl)purin-8-yl]-[1-[2-(2-pyridyl)ethyl]-4-piperidyl]amine Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CN=CN=C3N2CC4=CC=CO4)CCC5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1NC2=NC3=CN=CN=C3N2CC4=CC=CO4)CCC5=CC=CC=N5

InChI

InChI=1S/C22H25N7O/c1-2-9-24-17(4-1)6-10-28-11-7-18(8-12-28)26-22-27-20-14-23-16-25-21(20)29(22)15-19-5-3-13-30-19/h1-5,9,13-14,16,18H,6-8,10-12,15H2,(H,26,27)