Concept information
...
organic heterocyclic compound
organosulfur heterocyclic compound
thiophenes
thiophenecarboxylic acid
Preferred term
6,6-dimethyl-3-(methylthio)-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C12H14O3S2
inchi
- InChI=1S/C12H14O3S2/c1-12(2)4-6-8(7(13)5-12)11(16-3)17-9(6)10(14)15/h4-5H2,1-3H3,(H,14,15)
inchikey
- XOXHNCQEJNHCDW-UHFFFAOYSA-N
mass
- 270.370
monoisotopicmass
- 270.03844
smiles
- CC1(CC2=C(SC(=C2C(=O)C1)SC)C(=O)O)C
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:93049
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