2-ethyl-4-methyl-6-[2-(2-oxidanylideneimidazolidin-1-yl)ethylsulfanyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-[2-(2-oxidanylideneimidazolidin-1-yl)ethylsulfanyl]pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-[2-(2-oxoimidazolidin-1-yl)ethylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-[2-(2-oxo-1-imidazolidinyl)ethylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-[2-(2-oxoimidazolidin-1-yl)ethylsulfanyl]pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-[2-(2-ketoimidazolidin-1-yl)ethylthio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCCN2CCNC2=O)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCCN2CCNC2=O)C(=O)O)C

InChI

InChI=1S/C13H18N4O3S/c1-3-9-15-8(2)10(12(18)19)11(16-9)21-7-6-17-5-4-14-13(17)20/h3-7H2,1-2H3,(H,14,20)(H,18,19)