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6-tert-butylsulfanylpyridine-3-carboxylic acid

6-tert-butylsulfanylpyridine-3-carboxylic acid

Systemtic Name:6-tert-butylsulfanylpyridine-3-carboxylic acid
Openeye Name:6-tert-butylsulfanylpyridine-3-carboxylic acid
CAS Name:6-(tert-butylthio)-3-pyridinecarboxylic acid
IUPAC Name:6-tert-butylsulfanylpyridine-3-carboxylic acid
Traditional Name:6-(tert-butylthio)nicotinic acid
Formula: C10H13NO2S
MolecularWeight: 211.28072
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=NC=C(C=C1)C(=O)O


Isomeric SMILES

CC(C)(C)SC1=NC=C(C=C1)C(=O)O


InChI

InChI=1S/C10H13NO2S/c1-10(2,3)14-8-5-4-7(6-11-8)9(12)13/h4-6H,1-3H3,(H,12,13)


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