EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:112670 - 3-[(5-chloro-2,4-dimethoxyphenyl)-methylsulfamoyl]-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)benzamide

ChEBI IDCHEBI:112670
ChEBI Name3-[(5-chloro-2,4-dimethoxyphenyl)-methylsulfamoyl]-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)benzamide
Stars
DownloadsMolfile
FormulaC21H21ClN4O5S2
Net Charge0
Average Mass509.009
Monoisotopic Mass508.06419
SMILESCOc1cc(OC)c(N(C)S(=O)(=O)c2cccc(C(=O)Nc3nnc(C4CC4)s3)c2)cc1Cl
InChIInChI=1S/C21H21ClN4O5S2/c1-26(16-10-15(22)17(30-2)11-18(16)31-3)33(28,29)14-6-4-5-13(9-14)19(27)23-21-25-24-20(32-21)12-7-8-12/h4-6,9-12H,7-8H2,1-3H3,(H,23,25,27)
InChIKeyCFFQVBNJLIOUEN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[(5-chloro-2,4-dimethoxyphenyl)-methylsulfamoyl]-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)benzamide (CHEBI:112670) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-24080LINCS