EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:107400 - 2-[2-[[benzamido(sulfanylidene)methyl]amino]-4-thiazolyl]acetic acid ethyl ester

ChEBI IDCHEBI:107400
ChEBI Name2-[2-[[benzamido(sulfanylidene)methyl]amino]-4-thiazolyl]acetic acid ethyl ester
Stars
DownloadsMolfile
FormulaC15H15N3O3S2
Net Charge0
Average Mass349.437
Monoisotopic Mass349.05548
SMILESCCOC(=O)Cc1csc(NC(=S)NC(=O)c2ccccc2)n1
InChIInChI=1S/C15H15N3O3S2/c1-2-21-12(19)8-11-9-23-15(16-11)18-14(22)17-13(20)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,16,17,18,20,22)
InChIKeyNZKFCGVVILYGBE-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[2-[[benzamido(sulfanylidene)methyl]amino]-4-thiazolyl]acetic acid ethyl ester (CHEBI:107400) is a benzoic acids (CHEBI:22723)
Manual XrefsDatabases
LSM-18754LINCS