4-oxidanylidene-4-[[2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[[2-(thiazol-2-ylcarbamoyl)-3-pyridyl]amino]butanoic acid CAS Name: 4-oxo-4-[[2-[oxo-(2-thiazolylamino)methyl]-3-pyridinyl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl]amino]butanoic acid Traditional Name: 4-keto-4-[[2-(thiazol-2-ylcarbamoyl)-3-pyridyl]amino]butyric acid Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=O)NC2=NC=CS2)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)C(=O)NC2=NC=CS2)NC(=O)CCC(=O)O

InChI

InChI=1S/C13H12N4O4S/c18-9(3-4-10(19)20)16-8-2-1-5-14-11(8)12(21)17-13-15-6-7-22-13/h1-2,5-7H,3-4H2,(H,16,18)(H,19,20)(H,15,17,21)