(E)-2-oxidanyl-4-oxidanylidene-4-[4-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]but-2-enoic acid

Systemtic Name: (E)-2-oxidanyl-4-oxidanylidene-4-[4-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]but-2-enoic acid Openeye Name: (E)-2-hydroxy-4-oxo-4-[4-(4-pyridylmethyl)thiazol-2-yl]but-2-enoic acid CAS Name: (E)-2-hydroxy-4-oxo-4-[4-(pyridin-4-ylmethyl)-2-thiazolyl]-2-butenoic acid IUPAC Name: (E)-2-hydroxy-4-oxo-4-[4-(pyridin-4-ylmethyl)-1,3-thiazol-2-yl]but-2-enoic acid Traditional Name: (E)-2-hydroxy-4-keto-4-[4-(4-pyridylmethyl)thiazol-2-yl]but-2-enoic acid Formula: C13H10N2O4S MolecularWeight: 290.2945

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CC2=CSC(=N2)C(=O)C=C(C(=O)O)O

Isomeric SMILES

C1=CN=CC=C1CC2=CSC(=N2)C(=O)/C=C(\C(=O)O)/O

InChI

InChI=1S/C13H10N2O4S/c16-10(6-11(17)13(18)19)12-15-9(7-20-12)5-8-1-3-14-4-2-8/h1-4,6-7,17H,5H2,(H,18,19)/b11-6+