1-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-ol hydrochloride

Systemtic Name: 1-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-ol hydrochloride Openeye Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-ol hydrochloride CAS Name: 1-[6-amino-8-(2-furanyl)-9-methyl-2-purinyl]-4-methyl-1-pentyn-3-ol hydrochloride IUPAC Name: 1-[6-amino-8-(furan-2-yl)-9-methylpurin-2-yl]-4-methylpent-1-yn-3-ol hydrochloride Traditional Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-ol hydrochloride Formula: C16H18ClN5O2 MolecularWeight: 347.79942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC1=NC2=C(C(=N1)N)N=C(N2C)C3=CC=CO3)O.Cl

Isomeric SMILES

CC(C)C(C#CC1=NC2=C(C(=N1)N)N=C(N2C)C3=CC=CO3)O.Cl

InChI

InChI=1S/C16H17N5O2.ClH/c1-9(2)10(22)6-7-12-18-14(17)13-16(19-12)21(3)15(20-13)11-5-4-8-23-11;/h4-5,8-10,22H,1-3H3,(H2,17,18,19);1H