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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide
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Accession:CHEBI:7100 term browser browse the term
Definition:A 1,2-thiazole that has formula C20H16ClF3N2O2S.
Synonyms:related_synonym: Formula=C20H16ClF3N2O2S;   ITOPA;   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;   N-(Methylisothiazolin-5-ylidene)phenylacetamide;   SMILES=CN(C(=O)Cc1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)c1snc(C)c1Cl
 xref: KEGG:C10951


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 21771
    chemical entity 21769
      atom 21757
        nonmetal atom 21653
          nitrogen atom 19422
            nitrogen molecular entity 19422
              organonitrogen compound 19147
                carboxamide 17826
                  acetamides 12510
                    acetamide 5332
                      N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21771
    subatomic particle 21757
      composite particle 21757
        hadron 21757
          baryon 21757
            nucleon 21757
              atomic nucleus 21757
                atom 21757
                  main group element atom 21674
                    p-block element atom 21674
                      carbon group element atom 21487
                        carbon atom 21387
                          organic molecular entity 21387
                            organic group 19948
                              organic divalent group 19935
                                organodiyl group 19935
                                  carbonyl group 19920
                                    carbonyl compound 19920
                                      carboxylic acid 19248
                                        carboacyl group 18050
                                          univalent carboacyl group 18050
                                            carbamoyl group 17826
                                              carboxamide 17826
                                                acetamides 12510
                                                  acetamide 5332
                                                    N-(methyl-1,2-thiazolin-5-ylidene)phenylacetamide 0
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