N-[9-[[1-(2-hydroxyethyloxymethyl)-1,2,3-triazol-4-yl]methyl]-6-oxidanylidene-3H-purin-2-yl]ethanamide

Systemtic Name: N-[9-[[1-(2-hydroxyethyloxymethyl)-1,2,3-triazol-4-yl]methyl]-6-oxidanylidene-3H-purin-2-yl]ethanamide Openeye Name: N-[9-[[1-(2-hydroxyethoxymethyl)triazol-4-yl]methyl]-6-oxo-3H-purin-2-yl]acetamide CAS Name: N-[9-[[1-(2-hydroxyethoxymethyl)-4-triazolyl]methyl]-6-oxo-3H-purin-2-yl]acetamide IUPAC Name: N-[9-[[1-(2-hydroxyethoxymethyl)triazol-4-yl]methyl]-6-oxo-3H-purin-2-yl]acetamide Traditional Name: N-[9-[[1-(2-hydroxyethoxymethyl)triazol-4-yl]methyl]-6-keto-3H-purin-2-yl]acetamide Formula: C13H16N8O4 MolecularWeight: 348.31734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)CC3=CN(N=N3)COCCO

Isomeric SMILES

CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)CC3=CN(N=N3)COCCO

InChI

InChI=1S/C13H16N8O4/c1-8(23)15-13-16-11-10(12(24)17-13)14-6-20(11)4-9-5-21(19-18-9)7-25-3-2-22/h5-6,22H,2-4,7H2,1H3,(H2,15,16,17,23,24)