3-(4-methylsulfanyl-2-oxidanylidene-pyrimidin-1-yl)propanoic acid

Systemtic Name: 3-(4-methylsulfanyl-2-oxidanylidene-pyrimidin-1-yl)propanoic acid Openeye Name: 3-(4-methylsulfanyl-2-oxo-pyrimidin-1-yl)propanoic acid CAS Name: 3-[4-(methylthio)-2-oxo-1-pyrimidinyl]propanoic acid IUPAC Name: 3-(4-methylsulfanyl-2-oxopyrimidin-1-yl)propanoic acid Traditional Name: 3-[2-keto-4-(methylthio)pyrimidin-1-yl]propionic acid Formula: C8H10N2O3S MolecularWeight: 214.2416

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)N(C=C1)CCC(=O)O

Isomeric SMILES

CSC1=NC(=O)N(C=C1)CCC(=O)O

InChI

InChI=1S/C8H10N2O3S/c1-14-6-2-4-10(8(13)9-6)5-3-7(11)12/h2,4H,3,5H2,1H3,(H,11,12)