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

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ChEBI Name 2-(1,3-benzodioxol-5-ylmethylthio)-5-(2-furanyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone
ChEBI ID CHEBI:105537
Stars This entity has been manually annotated by a third party.
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Formula C21H16N2O4S2
Net Charge 0
Average Mass 424.496
Monoisotopic Mass 424.05515
InChI InChI=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
InChIKey OCKZFOSIMJBLQD-UHFFFAOYSA-N
SMILES C=CCN1C(=O)C2=C(N=C1SCC3=CC4=C(C=C3)OCO4)SC=C2C5=CC=CO5
ChEBI Ontology
Outgoing 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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