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CHEBI:109842 - 2-amino-4-[(4-bromophenyl)methylthio]-3-azaspiro[5.5]undeca-1,4-diene-1,5-dicarbonitrile

Default Structure
ChEBI IDCHEBI:109842
ChEBI Name2-amino-4-[(4-bromophenyl)methylthio]-3-azaspiro[5.5]undeca-1,4-diene-1,5-dicarbonitrile
Stars
DownloadsMolfile
FormulaC19H19BrN4S
Net Charge0
Average Mass415.360
Monoisotopic Mass414.05138
SMILESN#CC1=C(N)NC(SCc2ccc(Br)cc2)=C(C#N)C12CCCCC2
InChIInChI=1S/C19H19BrN4S/c20-14-6-4-13(5-7-14)12-25-18-16(11-22)19(8-2-1-3-9-19)15(10-21)17(23)24-18/h4-7,24H,1-3,8-9,12,23H2
InChIKeyAHWXPMSTZOIWOT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-amino-4-[(4-bromophenyl)methylthio]-3-azaspiro[5.5]undeca-1,4-diene-1,5-dicarbonitrile (CHEBI:109842) is a organobromine compound (CHEBI:37141)
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