2-[4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 2-[4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanoylamino]thiophene-3-carboxylic acid Openeye Name: 2-[4-(4-methyl-2-oxo-thiazol-3-yl)butanoylamino]thiophene-3-carboxylic acid CAS Name: 2-[[4-(4-methyl-2-oxo-3-thiazolyl)-1-oxobutyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanoylamino]thiophene-3-carboxylic acid Traditional Name: 2-[4-(2-keto-4-methyl-4-thiazolin-3-yl)butanoylamino]-3-thenoic acid Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CCCC(=O)NC2=C(C=CS2)C(=O)O

Isomeric SMILES

CC1=CSC(=O)N1CCCC(=O)NC2=C(C=CS2)C(=O)O

InChI

InChI=1S/C13H14N2O4S2/c1-8-7-21-13(19)15(8)5-2-3-10(16)14-11-9(12(17)18)4-6-20-11/h4,6-7H,2-3,5H2,1H3,(H,14,16)(H,17,18)