EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:113088 - 5-amino-4-(1,3-benzothiazol-2-yl)-1-phenyl-2H-pyrrol-3-one

ChEBI IDCHEBI:113088
ChEBI Name5-amino-4-(1,3-benzothiazol-2-yl)-1-phenyl-2H-pyrrol-3-one
Stars
DownloadsMolfile
FormulaC17H13N3OS
Net Charge0
Average Mass307.378
Monoisotopic Mass307.07793
SMILESNC1=C(c2nc3ccccc3s2)C(=O)CN1c1ccccc1
InChIInChI=1S/C17H13N3OS/c18-16-15(17-19-12-8-4-5-9-14(12)22-17)13(21)10-20(16)11-6-2-1-3-7-11/h1-9H,10,18H2
InChIKeyVNPXKXSKKUVBEM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-amino-4-(1,3-benzothiazol-2-yl)-1-phenyl-2H-pyrrol-3-one (CHEBI:113088) is a pyrroline (CHEBI:23763)
Manual XrefsDatabases
LSM-24498LINCS