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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=C(N2C)N=C(N=C3N)C#CC4(CCCCC4)O.Cl

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=C(N2C)N=C(N=C3N)C#CC4(CCCCC4)O.Cl

InChI

InChI=1S/C19H21N5O2.ClH/c1-12-6-7-13(26-12)17-23-15-16(20)21-14(22-18(15)24(17)2)8-11-19(25)9-4-3-5-10-19;/h6-7,25H,3-5,9-10H2,1-2H3,(H2,20,21,22);1H