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Concept information

Preferred term

2-[(3,4-dimethylphenyl)thio]-3-pyridinecarboxylic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C14H13NO2S

inchi

  • InChI=1S/C14H13NO2S/c1-9-5-6-11(8-10(9)2)18-13-12(14(16)17)4-3-7-15-13/h3-8H,1-2H3,(H,16,17)

inchikey

  • CRLOVVXMPXCXPM-UHFFFAOYSA-N

mass

  • 259.325

monoisotopicmass

  • 259.06670

smiles

  • CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)O)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:111414

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