5-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylic acid Openeye Name: 5-[[5-(carboxymethyl)-4-methyl-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylic acid CAS Name: 5-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylic acid Traditional Name: 5-[[[5-(carboxymethyl)-4-methyl-thiazol-2-yl]thio]methyl]-2-thenoic acid Formula: C12H11NO4S3 MolecularWeight: 329.41504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC2=CC=C(S2)C(=O)O)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC2=CC=C(S2)C(=O)O)CC(=O)O

InChI

InChI=1S/C12H11NO4S3/c1-6-9(4-10(14)15)20-12(13-6)18-5-7-2-3-8(19-7)11(16)17/h2-3H,4-5H2,1H3,(H,14,15)(H,16,17)