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

Systemtic Name: 1-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-one Openeye Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-one CAS Name: 1-[6-amino-8-(2-furanyl)-9-methyl-2-purinyl]-4-methyl-1-pentyn-3-one IUPAC Name: 1-[6-amino-8-(furan-2-yl)-9-methylpurin-2-yl]-4-methylpent-1-yn-3-one Traditional Name: 1-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-4-methyl-pent-1-yn-3-one Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N5O2/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/h4-5,8-9H,1-3H3,(H2,17,18,19)