2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(2-ethylthiazol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(2-ethyl-4-thiazolyl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[(2-ethylthiazol-4-yl)methylthio]nicotinic acid Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CCC1=NC(=CS1)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C12H12N2O2S2/c1-2-10-14-8(6-17-10)7-18-11-9(12(15)16)4-3-5-13-11/h3-6H,2,7H2,1H3,(H,15,16)