EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:120872 - N-[5-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide

ChEBI IDCHEBI:120872
ChEBI NameN-[5-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide
Stars
DownloadsMolfile
FormulaC17H14N4O5S2
Net Charge0
Average Mass418.456
Monoisotopic Mass418.04056
SMILESO=C(CSc1nnc(NC(=O)c2ccc3c(c2)OCO3)s1)NCc1ccco1
InChIInChI=1S/C17H14N4O5S2/c22-14(18-7-11-2-1-5-24-11)8-27-17-21-20-16(28-17)19-15(23)10-3-4-12-13(6-10)26-9-25-12/h1-6H,7-9H2,(H,18,22)(H,19,20,23)
InChIKeyLVPFTFPRHGPUHX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[5-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide (CHEBI:120872) is a benzodioxoles (CHEBI:38298)
Manual XrefsDatabases
LSM-32315LINCS