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

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[4-[(3-methylphenyl)methyl]piperidin-1-yl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[4-(m-tolylmethyl)-1-piperidyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[4-[(3-methylphenyl)methyl]-1-piperidinyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[4-[(3-methylphenyl)methyl]piperidin-1-yl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[4-(3-methylbenzyl)piperidino]amine Formula: C23H29ClN6 MolecularWeight: 424.96956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2CCN(CC2)NC3=NC(=NC4=C3N=CN4C5CCCC5)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CC2CCN(CC2)NC3=NC(=NC4=C3N=CN4C5CCCC5)Cl

InChI

InChI=1S/C23H29ClN6/c1-16-5-4-6-18(13-16)14-17-9-11-29(12-10-17)28-21-20-22(27-23(24)26-21)30(15-25-20)19-7-2-3-8-19/h4-6,13,15,17,19H,2-3,7-12,14H2,1H3,(H,26,27,28)