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CHEBI:109814 - 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one

ChEBI IDCHEBI:109814
ChEBI Name2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one
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DownloadsMolfile
FormulaC20H23N3O2S2
Net Charge0
Average Mass401.557
Monoisotopic Mass401.12317
SMILESC=CCn1c(SCc2c(C)noc2C)nc2sc3c(c2c1=O)CCCCC3
InChIInChI=1S/C20H23N3O2S2/c1-4-10-23-19(24)17-14-8-6-5-7-9-16(14)27-18(17)21-20(23)26-11-15-12(2)22-25-13(15)3/h4H,1,5-11H2,2-3H3
InChIKeyRBTURZSCIGSYAQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one (CHEBI:109814) is a organic heterobicyclic compound (CHEBI:27171)
2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one (CHEBI:109814) is a organonitrogen heterocyclic compound (CHEBI:38101)
2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one (CHEBI:109814) is a organosulfur heterocyclic compound (CHEBI:38106)
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