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

Systemtic Name: 2-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]pyridine-4-carboxylic acid Openeye Name: 2-[5-(carboxymethyl)-4-methyl-thiazol-2-yl]sulfanylpyridine-4-carboxylic acid CAS Name: 2-[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]-4-pyridinecarboxylic acid IUPAC Name: 2-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]pyridine-4-carboxylic acid Traditional Name: 2-[[5-(carboxymethyl)-4-methyl-thiazol-2-yl]thio]isonicotinic acid Formula: C12H10N2O4S2 MolecularWeight: 310.3488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC2=NC=CC(=C2)C(=O)O)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SC2=NC=CC(=C2)C(=O)O)CC(=O)O

InChI

InChI=1S/C12H10N2O4S2/c1-6-8(5-10(15)16)19-12(14-6)20-9-4-7(11(17)18)2-3-13-9/h2-4H,5H2,1H3,(H,15,16)(H,17,18)