1-[2-(6-azanyl-8-cyclohexyl-9-methyl-purin-2-yl)ethynyl]cyclohexan-1-ol hydrochloride

Systemtic Name: 1-[2-(6-azanyl-8-cyclohexyl-9-methyl-purin-2-yl)ethynyl]cyclohexan-1-ol hydrochloride Openeye Name: 1-[2-(6-amino-8-cyclohexyl-9-methyl-purin-2-yl)ethynyl]cyclohexanol hydrochloride CAS Name: 1-[2-(6-amino-8-cyclohexyl-9-methyl-2-purinyl)ethynyl]-1-cyclohexanol hydrochloride IUPAC Name: 1-[2-(6-amino-8-cyclohexyl-9-methylpurin-2-yl)ethynyl]cyclohexan-1-ol hydrochloride Traditional Name: 1-[2-(6-amino-8-cyclohexyl-9-methyl-purin-2-yl)ethynyl]cyclohexanol hydrochloride Formula: C20H28ClN5O MolecularWeight: 389.92222

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1N=C(N=C2N)C#CC3(CCCCC3)O)C4CCCCC4.Cl

Isomeric SMILES

CN1C(=NC2=C1N=C(N=C2N)C#CC3(CCCCC3)O)C4CCCCC4.Cl

InChI

InChI=1S/C20H27N5O.ClH/c1-25-18(14-8-4-2-5-9-14)24-16-17(21)22-15(23-19(16)25)10-13-20(26)11-6-3-7-12-20;/h14,26H,2-9,11-12H2,1H3,(H2,21,22,23);1H