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2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carboxylic acid

2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carboxylic acid

Systemtic Name:2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carboxylic acid
Openeye Name:2-(2-pyridylmethylsulfanyl)pyridine-3-carboxylic acid
CAS Name:2-(2-pyridinylmethylthio)-3-pyridinecarboxylic acid
IUPAC Name:2-(pyridin-2-ylmethylsulfanyl)pyridine-3-carboxylic acid
Traditional Name:2-(2-pyridylmethylthio)nicotinic acid
Formula: C12H10N2O2S
MolecularWeight: 246.285
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H10N2O2S/c15-12(16)10-5-3-7-14-11(10)17-8-9-4-1-2-6-13-9/h1-7H,8H2,(H,15,16)


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