8-(furan-2-yl)-2-hex-1-ynyl-9-methyl-purin-6-amine hydrochloride

Systemtic Name: 8-(furan-2-yl)-2-hex-1-ynyl-9-methyl-purin-6-amine hydrochloride Openeye Name: 8-(2-furyl)-2-hex-1-ynyl-9-methyl-purin-6-amine hydrochloride CAS Name: 8-(2-furanyl)-2-hex-1-ynyl-9-methyl-6-purinamine hydrochloride IUPAC Name: 8-(furan-2-yl)-2-hex-1-ynyl-9-methylpurin-6-amine hydrochloride Traditional Name: [8-(2-furyl)-2-hex-1-ynyl-9-methyl-purin-6-yl]amine hydrochloride Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O.ClH/c1-3-4-5-6-9-12-18-14(17)13-16(19-12)21(2)15(20-13)11-8-7-10-22-11;/h7-8,10H,3-5H2,1-2H3,(H2,17,18,19);1H