3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid

Systemtic Name: 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid Openeye Name: 3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoic acid CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid IUPAC Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid Formula: C8H10N2O3S MolecularWeight: 214.2416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)O

InChI

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