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CHEBI:105355 - 3-(4-chlorophenyl)-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione

ChEBI IDCHEBI:105355
ChEBI Name3-(4-chlorophenyl)-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione
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DownloadsMolfile
FormulaC20H17ClN6S
Net Charge0
Average Mass408.918
Monoisotopic Mass408.09239
SMILESCc1nn(-c2ccccc2)c(C)c1C=Nn1c(-c2ccc(Cl)cc2)nnc1=S
InChIInChI=1S/C20H17ClN6S/c1-13-18(14(2)26(25-13)17-6-4-3-5-7-17)12-22-27-19(23-24-20(27)28)15-8-10-16(21)11-9-15/h3-12H,1-2H3,(H,24,28)
InChIKeyLWSYTJWXSMGIKM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(4-chlorophenyl)-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione (CHEBI:105355) is a pyrazoles (CHEBI:26410)
3-(4-chlorophenyl)-4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione (CHEBI:105355) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-16718LINCS