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2-[1-[6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]piperidin-2-yl]ethanol

2-[1-[6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]piperidin-2-yl]ethanol

Systemtic Name:2-[1-[6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]piperidin-2-yl]ethanol
Openeye Name:2-[1-[6-(3-chloroanilino)-9-isopropyl-purin-2-yl]-2-piperidyl]ethanol
CAS Name:2-[1-[6-(3-chloroanilino)-9-propan-2-yl-2-purinyl]-2-piperidinyl]ethanol
IUPAC Name:2-[1-[6-(3-chloroanilino)-9-propan-2-ylpurin-2-yl]piperidin-2-yl]ethanol
Traditional Name:2-[1-[6-(3-chloroanilino)-9-isopropyl-purin-2-yl]-2-piperidyl]ethanol
Formula: C21H27ClN6O
MolecularWeight: 414.93168
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCCCC4CCO


Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCCCC4CCO


InChI

InChI=1S/C21H27ClN6O/c1-14(2)28-13-23-18-19(24-16-7-5-6-15(22)12-16)25-21(26-20(18)28)27-10-4-3-8-17(27)9-11-29/h5-7,12-14,17,29H,3-4,8-11H2,1-2H3,(H,24,25,26)


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