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CHEBI:105424 - 2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile

ChEBI IDCHEBI:105424
ChEBI Name2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile
Stars
DownloadsMolfile
FormulaC16H13N3OS
Net Charge0
Average Mass295.367
Monoisotopic Mass295.07793
SMILESCc1ccc(-c2csc3ncn(CC#N)c(=O)c23)cc1C
InChIInChI=1S/C16H13N3OS/c1-10-3-4-12(7-11(10)2)13-8-21-15-14(13)16(20)19(6-5-17)9-18-15/h3-4,7-9H,6H2,1-2H3
InChIKeyOFUZKQAUTNCHRE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile (CHEBI:105424) is a organic heterobicyclic compound (CHEBI:27171)
2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile (CHEBI:105424) is a organonitrogen heterocyclic compound (CHEBI:38101)
2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile (CHEBI:105424) is a organosulfur heterocyclic compound (CHEBI:38106)
Manual XrefsDatabases
LSM-16787LINCS