3-[(5-methyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(5-methyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Openeye Name: 3-[(5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid CAS Name: 3-[(5-methyl-6-oxo-1H-pyrimidin-2-yl)thio]propanoic acid IUPAC Name: 3-[(5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Traditional Name: 3-[(6-keto-5-methyl-1H-pyrimidin-2-yl)thio]propionic acid Formula: C8H10N2O3S MolecularWeight: 214.2416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(NC1=O)SCCC(=O)O

Isomeric SMILES

CC1=CN=C(NC1=O)SCCC(=O)O

InChI

InChI=1S/C8H10N2O3S/c1-5-4-9-8(10-7(5)13)14-3-2-6(11)12/h4H,2-3H2,1H3,(H,11,12)(H,9,10,13)