CHEBI:7100 - N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide
ChEBI ID CHEBI:7100
ChEBI ASCII Name N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H16ClF3N2O2S
Net Charge 0
Average Mass 440.868
Monoisotopic Mass 440.05731
InChI InChI=1S/C20H16ClF3N2O2S/c1-12-18(21)19(29-25-12)26(2)17(27)11-13-3-7-15(8-4-13)28-16-9-5-14(6-10-16)20(22,23)24/h3-10H,11H2,1-2H3
InChIKey AWUHASQZSYOAQH-UHFFFAOYSA-N
SMILES CN(C(=O)Cc1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)c1snc(C)c1Cl
ChEBI Ontology
Outgoing N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide (CHEBI:7100) has functional parent acetamide (CHEBI:27856)
N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide (CHEBI:7100) is a 1,2-thiazoles (CHEBI:48902)
Synonyms Sources
ITOPA KEGG COMPOUND
N-(Methylisothiazolin-5-ylidene)phenylacetamide KEGG COMPOUND
Manual Xref Database
C10951 KEGG COMPOUND
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Last Modified
28 July 2014