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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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