2-azanyl-1-ethynyl-6-[9-methyl-8-(5-methylfuran-2-yl)purin-2-yl]cyclohexan-1-ol hydrochloride

Systemtic Name: 2-azanyl-1-ethynyl-6-[9-methyl-8-(5-methylfuran-2-yl)purin-2-yl]cyclohexan-1-ol hydrochloride Openeye Name: 2-amino-1-ethynyl-6-[9-methyl-8-(5-methyl-2-furyl)purin-2-yl]cyclohexanol hydrochloride CAS Name: 2-amino-1-ethynyl-6-[9-methyl-8-(5-methyl-2-furanyl)-2-purinyl]-1-cyclohexanol hydrochloride IUPAC Name: 2-amino-1-ethynyl-6-[9-methyl-8-(5-methylfuran-2-yl)purin-2-yl]cyclohexan-1-ol hydrochloride Traditional Name: 2-amino-1-ethynyl-6-[9-methyl-8-(5-methyl-2-furyl)purin-2-yl]cyclohexanol hydrochloride Formula: C19H22ClN5O2 MolecularWeight: 387.86328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CN=C(N=C3N2C)C4CCCC(C4(C#C)O)N.Cl

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CN=C(N=C3N2C)C4CCCC(C4(C#C)O)N.Cl

InChI

InChI=1S/C19H21N5O2.ClH/c1-4-19(25)12(6-5-7-15(19)20)16-21-10-13-17(23-16)24(3)18(22-13)14-9-8-11(2)26-14;/h1,8-10,12,15,25H,5-7,20H2,2-3H3;1H