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

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[4-[1-(phenylsulfinyl)ethyl]piperidin-1-yl]purin-6-amine Openeye Name: N-[4-[1-(benzenesulfinyl)ethyl]-1-piperidyl]-2-chloro-9-cyclopentyl-purin-6-amine CAS Name: N-[4-[1-(benzenesulfinyl)ethyl]-1-piperidinyl]-2-chloro-9-cyclopentyl-6-purinamine IUPAC Name: N-[4-[1-(benzenesulfinyl)ethyl]piperidin-1-yl]-2-chloro-9-cyclopentylpurin-6-amine Traditional Name: [4-[1-(benzenesulfinyl)ethyl]piperidino]-(2-chloro-9-cyclopentyl-purin-6-yl)amine Formula: C23H29ClN6OS MolecularWeight: 473.03396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)S(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)S(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H29ClN6OS/c1-16(32(31)19-9-3-2-4-10-19)17-11-13-29(14-12-17)28-21-20-22(27-23(24)26-21)30(15-25-20)18-7-5-6-8-18/h2-4,9-10,15-18H,5-8,11-14H2,1H3,(H,26,27,28)