4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-(1,3-dioxan-4-ylmethylthio)-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-(1,3-dioxan-4-ylmethylsulfanyl)-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-(1,3-dioxan-4-ylmethylthio)-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C11H14N2O5S MolecularWeight: 286.30426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2CCOCO2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2CCOCO2)C(=O)O

InChI

InChI=1S/C11H14N2O5S/c1-6-8(10(14)15)9(13-11(16)12-6)19-4-7-2-3-17-5-18-7/h7H,2-5H2,1H3,(H,14,15)(H,12,13,16)