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CHEBI:119878 - 2-thiophenecarboxylic acid [4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenyl] ester

ChEBI IDCHEBI:119878
ChEBI Name2-thiophenecarboxylic acid [4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenyl] ester
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FormulaC22H15N3O2S
Net Charge0
Average Mass385.448
Monoisotopic Mass385.08850
SMILESCc1ccc2nc(C(C#N)=Cc3ccc(OC(=O)c4cccs4)cc3)nc2c1
InChIInChI=1S/C22H15N3O2S/c1-14-4-9-18-19(11-14)25-21(24-18)16(13-23)12-15-5-7-17(8-6-15)27-22(26)20-3-2-10-28-20/h2-12H,1H3,(H,24,25)
InChIKeyQXYPVJXRFOEQBR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-thiophenecarboxylic acid [4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenyl] ester (CHEBI:119878) is a benzoate ester (CHEBI:36054)
2-thiophenecarboxylic acid [4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenyl] ester (CHEBI:119878) is a phenols (CHEBI:33853)
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