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

Systemtic Name: 2-chloranyl-N-[4-[(3-chloranyl-4-methyl-phenyl)methyl]piperidin-1-yl]-9-cyclopentyl-purin-6-amine Openeye Name: 2-chloro-N-[4-[(3-chloro-4-methyl-phenyl)methyl]-1-piperidyl]-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-N-[4-[(3-chloro-4-methylphenyl)methyl]-1-piperidinyl]-9-cyclopentyl-6-purinamine IUPAC Name: 2-chloro-N-[4-[(3-chloro-4-methylphenyl)methyl]piperidin-1-yl]-9-cyclopentylpurin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[4-(3-chloro-4-methyl-benzyl)piperidino]amine Formula: C23H28Cl2N6 MolecularWeight: 459.41462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28Cl2N6/c1-15-6-7-17(13-19(15)24)12-16-8-10-30(11-9-16)29-21-20-22(28-23(25)27-21)31(14-26-20)18-4-2-3-5-18/h6-7,13-14,16,18H,2-5,8-12H2,1H3,(H,27,28,29)