2-chloranyl-9-cyclopentyl-N-[4-(pyridin-3-ylmethyl)piperidin-1-yl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[4-(pyridin-3-ylmethyl)piperidin-1-yl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[4-(3-pyridylmethyl)-1-piperidyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[4-(3-pyridinylmethyl)-1-piperidinyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[4-(pyridin-3-ylmethyl)piperidin-1-yl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[4-(3-pyridylmethyl)piperidino]amine Formula: C21H26ClN7 MolecularWeight: 411.93104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5=CN=CC=C5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5=CN=CC=C5)Cl

InChI

InChI=1S/C21H26ClN7/c22-21-25-19(18-20(26-21)29(14-24-18)17-5-1-2-6-17)27-28-10-7-15(8-11-28)12-16-4-3-9-23-13-16/h3-4,9,13-15,17H,1-2,5-8,10-12H2,(H,25,26,27)