[3-acetyloxy-2-ethynyl-4-oxidanyl-5-[2-oxidanylidene-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-acetyloxy-2-ethynyl-4-oxidanyl-5-[2-oxidanylidene-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3-acetoxy-2-ethynyl-4-hydroxy-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-acetyloxy-2-ethynyl-4-hydroxy-5-[2-oxo-4-(1,2,4-triazol-1-yl)-1-pyrimidinyl]-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-2-ethynyl-4-hydroxy-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-acetoxy-2-ethynyl-4-hydroxy-5-[2-keto-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl ester Formula: C17H17N5O7 MolecularWeight: 403.34618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(C(C(O1)N2C=CC(=NC2=O)N3C=NC=N3)O)OC(=O)C)C#C

Isomeric SMILES

CC(=O)OCC1(C(C(C(O1)N2C=CC(=NC2=O)N3C=NC=N3)O)OC(=O)C)C#C

InChI

InChI=1S/C17H17N5O7/c1-4-17(7-27-10(2)23)14(28-11(3)24)13(25)15(29-17)21-6-5-12(20-16(21)26)22-9-18-8-19-22/h1,5-6,8-9,13-15,25H,7H2,2-3H3