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CHEBI:108131 - 2-(1H-benzimidazol-2-yl)-4-(3,4-dimethoxyphenyl)-3-oxobutanenitrile

ChEBI IDCHEBI:108131
ChEBI Name2-(1H-benzimidazol-2-yl)-4-(3,4-dimethoxyphenyl)-3-oxobutanenitrile
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FormulaC19H17N3O3
Net Charge0
Average Mass335.363
Monoisotopic Mass335.12699
SMILESCOc1ccc(CC(=O)C(C#N)c2nc3ccccc3n2)cc1OC
InChIInChI=1S/C19H17N3O3/c1-24-17-8-7-12(10-18(17)25-2)9-16(23)13(11-20)19-21-14-5-3-4-6-15(14)22-19/h3-8,10,13H,9H2,1-2H3,(H,21,22)
InChIKeyYABKZGMDARWCEV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(1H-benzimidazol-2-yl)-4-(3,4-dimethoxyphenyl)-3-oxobutanenitrile (CHEBI:108131) is a dimethoxybenzene (CHEBI:51681)
Manual XrefsDatabases
LSM-19508LINCS