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

Systemtic Name: 1-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-4-methyl-3-propan-2-yl-pent-1-yn-3-ol hydrochloride Openeye Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-3-isopropyl-4-methyl-pent-1-yn-3-ol hydrochloride CAS Name: 1-[6-amino-8-(2-furanyl)-9-methyl-2-purinyl]-4-methyl-3-propan-2-yl-1-pentyn-3-ol hydrochloride IUPAC Name: 1-[6-amino-8-(furan-2-yl)-9-methylpurin-2-yl]-4-methyl-3-propan-2-ylpent-1-yn-3-ol hydrochloride Traditional Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-3-isopropyl-4-methyl-pent-1-yn-3-ol hydrochloride Formula: C19H24ClN5O2 MolecularWeight: 389.87916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5O2.ClH/c1-11(2)19(25,12(3)4)9-8-14-21-16(20)15-18(22-14)24(5)17(23-15)13-7-6-10-26-13;/h6-7,10-12,25H,1-5H3,(H2,20,21,22);1H