2-[(2-methylsulfanylpyridin-4-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2-methylsulfanylpyridin-4-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(2-methylsulfanyl-4-pyridyl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[[2-(methylthio)-4-pyridinyl]methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(2-methylsulfanylpyridin-4-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[[2-(methylthio)-4-pyridyl]methylthio]nicotinic acid Formula: C13H12N2O2S2 MolecularWeight: 292.37658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CSC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H12N2O2S2/c1-18-11-7-9(4-6-14-11)8-19-12-10(13(16)17)3-2-5-15-12/h2-7H,8H2,1H3,(H,16,17)