[5-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxycarbonylphosphonic acid

Systemtic Name: [5-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxycarbonylphosphonic acid Openeye Name: [5-(4-acetamido-2-oxo-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxycarbonylphosphonic acid CAS Name: [[5-(4-acetamido-2-oxo-1-pyrimidinyl)-1,3-oxathiolan-2-yl]methoxy-oxomethyl]phosphonic acid IUPAC Name: [5-(4-acetamido-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxycarbonylphosphonic acid Traditional Name: [5-(4-acetamido-2-keto-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxycarbonylphosphonic acid Formula: C11H14N3O8PS MolecularWeight: 379.282921

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)N(C=C1)C2CSC(O2)COC(=O)P(=O)(O)O

Isomeric SMILES

CC(=O)NC1=NC(=O)N(C=C1)C2CSC(O2)COC(=O)P(=O)(O)O

InChI

InChI=1S/C11H14N3O8PS/c1-6(15)12-7-2-3-14(10(16)13-7)8-5-24-9(22-8)4-21-11(17)23(18,19)20/h2-3,8-9H,4-5H2,1H3,(H2,18,19,20)(H,12,13,15,16)