2-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(5-ethyl-2-thienyl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(5-ethyl-2-thiophenyl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[(5-ethyl-2-thienyl)methylthio]nicotinic acid Formula: C13H13NO2S2 MolecularWeight: 279.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H13NO2S2/c1-2-9-5-6-10(18-9)8-17-12-11(13(15)16)4-3-7-14-12/h3-7H,2,8H2,1H3,(H,15,16)