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CHEBI:122087 - N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide

ChEBI IDCHEBI:122087
ChEBI NameN-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide
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DownloadsMolfile
FormulaC21H22ClN3O3S
Net Charge0
Average Mass431.945
Monoisotopic Mass431.10704
SMILESO=C(NC(=S)Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C21H22ClN3O3S/c22-16-13-15(5-6-17(16)25-8-2-1-3-9-25)23-21(29)24-20(26)14-4-7-18-19(12-14)28-11-10-27-18/h4-7,12-13H,1-3,8-11H2,(H2,23,24,26,29)
InChIKeyUIENYKHISAKOLS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide (CHEBI:122087) is a thioureas (CHEBI:51276)
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