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CHEBI:105537 - 2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone

ChEBI IDCHEBI:105537
ChEBI Name2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone
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FormulaC21H16N2O4S2
Net Charge0
Average Mass424.503
Monoisotopic Mass424.05515
SMILESC=CCn1c(SCc2ccc3c(c2)OCO3)nc2scc(-c3ccco3)c2c1=O
InChIInChI=1S/C21H16N2O4S2/c1-2-7-23-20(24)18-14(15-4-3-8-25-15)11-28-19(18)22-21(23)29-10-13-5-6-16-17(9-13)27-12-26-16/h2-6,8-9,11H,1,7,10,12H2
InChIKeyOCKZFOSIMJBLQD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone (CHEBI:105537) is a organic heterobicyclic compound (CHEBI:27171)
2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone (CHEBI:105537) is a organonitrogen heterocyclic compound (CHEBI:38101)
2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone (CHEBI:105537) is a organosulfur heterocyclic compound (CHEBI:38106)
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