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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)S(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)S(=O)C5=CC=CC=C5

InChI

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