3-[4,6-dimethyl-1-(5-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[4,6-dimethyl-1-(5-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4,6-dimethyl-1-(5-methylthiazol-2-yl)-2-oxo-pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-1-(5-methyl-2-thiazolyl)-2-oxo-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-1-(5-methyl-1,3-thiazol-2-yl)-2-oxopyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-keto-4,6-dimethyl-1-(5-methylthiazol-2-yl)pyrimidin-5-yl]propionic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

Isomeric SMILES

CC1=CN=C(S1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

InChI

InChI=1S/C13H15N3O3S/c1-7-6-14-13(20-7)16-9(3)10(4-5-11(17)18)8(2)15-12(16)19/h6H,4-5H2,1-3H3,(H,17,18)