EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:116130 - 2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-nitrophenyl)acetamide

ChEBI IDCHEBI:116130
ChEBI Name2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-nitrophenyl)acetamide
Stars
DownloadsMolfile
FormulaC17H15N5O3S2
Net Charge0
Average Mass401.473
Monoisotopic Mass401.06163
SMILESCc1ccccc1Nc1nnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])s1
InChIInChI=1S/C17H15N5O3S2/c1-11-6-2-3-7-12(11)19-16-20-21-17(27-16)26-10-15(23)18-13-8-4-5-9-14(13)22(24)25/h2-9H,10H2,1H3,(H,18,23)(H,19,20)
InChIKeyOIWXYXFBRDMAIX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-nitrophenyl)acetamide (CHEBI:116130) is a C-nitro compound (CHEBI:35716)
Manual XrefsDatabases
LSM-27586LINCS