6-methyl-4-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-4-[2-(methylamino)-2-oxo-ethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-4-[[2-(methylamino)-2-oxoethyl]thio]-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-4-[2-(methylamino)-2-oxoethyl]sulfanyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-4-[[2-keto-2-(methylamino)ethyl]thio]-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C9H11N3O4S MolecularWeight: 257.26634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N3O4S/c1-4-6(8(14)15)7(12-9(16)11-4)17-3-5(13)10-2/h3H2,1-2H3,(H,10,13)(H,14,15)(H,11,12,16)