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

Systemtic Name: 6-methyl-2-oxidanylidene-4-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanyl-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanyl-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]thio]-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanyl-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-4-[[2-keto-2-(2-ketopyrrolidino)ethyl]thio]-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)N2CCCC2=O)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)N2CCCC2=O)C(=O)O

InChI

InChI=1S/C12H13N3O5S/c1-6-9(11(18)19)10(14-12(20)13-6)21-5-8(17)15-4-2-3-7(15)16/h2-5H2,1H3,(H,18,19)(H,13,14,20)