EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:112284 - 5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester

ChEBI IDCHEBI:112284
ChEBI Name5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC16H15N3O4S
Net Charge0
Average Mass345.380
Monoisotopic Mass345.07833
SMILESCCOC(=O)c1nn(-c2ccc(OC)cc2)c(=O)c2c(N)scc12
InChIInChI=1S/C16H15N3O4S/c1-3-23-16(21)13-11-8-24-14(17)12(11)15(20)19(18-13)9-4-6-10(22-2)7-5-9/h4-8H,3,17H2,1-2H3
InChIKeyZHOXCPCRQLGLIL-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester (CHEBI:112284) is a methoxybenzenes (CHEBI:51683)
5-amino-3-(4-methoxyphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester (CHEBI:112284) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-23696LINCS