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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCNC(C4)CC5=CC=NC=C5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCNC(C4)CC5=CC=NC=C5)Cl

InChI

InChI=1S/C21H26ClN7/c22-21-27-19(18-20(28-21)29(13-25-18)17-3-1-2-4-17)26-15-7-10-24-16(12-15)11-14-5-8-23-9-6-14/h5-6,8-9,13,15-17,24H,1-4,7,10-12H2,(H,26,27,28)