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CHEBI:108562 - 3-nitro-4-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]benzamide

ChEBI IDCHEBI:108562
ChEBI Name3-nitro-4-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]benzamide
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FormulaC18H17N5O4S2
Net Charge0
Average Mass431.499
Monoisotopic Mass431.07220
SMILESNC(=O)c1ccc(Sc2nnc(-c3cccs3)n2CC2CCCO2)c([N+](=O)[O-])c1
InChIInChI=1S/C18H17N5O4S2/c19-16(24)11-5-6-14(13(9-11)23(25)26)29-18-21-20-17(15-4-2-8-28-15)22(18)10-12-3-1-7-27-12/h2,4-6,8-9,12H,1,3,7,10H2,(H2,19,24)
InChIKeyPDZHTLVMZXEBHV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-nitro-4-[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]benzamide (CHEBI:108562) is a aryl sulfide (CHEBI:35683)
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