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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:thiophanate
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Accession:CHEBI:82060 term browser browse the term
Definition:A member of the class of thioureas that is the diethyl ester of (1,2-phenylenedicarbamothioyl)biscarbamic acid. A fungicide effective against a broad spectrum of diseases in fruit, vegetables, turf and other crops including eyespot, scab, powdery mildew and grey mould.
Synonyms:exact_synonym: diethyl (1,2-phenylenedicarbamothioyl)biscarbamate
 related_synonym: 1,2-Bis(3-ethoxycarbonyl-2-thioureido) benzene;   1,2-Di-(3-ethoxycarbonyl-2-thioureido)benzene;   4,4'-o-Phenylenebis(ethyl 3-thioallophanate);   Diethyl 4,4'-o-phenylenebis(3-thioallophanate);   Ethyl thiophanate;   Formula=C14H18N4O4S2;   InChI=1S/C14H18N4O4S2/c1-3-21-13(19)17-11(23)15-9-7-5-6-8-10(9)16-12(24)18-14(20)22-4-2/h5-8H,3-4H2,1-2H3,(H2,15,17,19,23)(H2,16,18,20,24);   InChIKey=YFNCATAIYKQPOO-UHFFFAOYSA-N;   SMILES=CCOC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OCC;   Thiophanat;   diethyl N,N'-[1,2-phenylenebis(azanediylcarbonothioyl)]dicarbamate;   diethyl N,N'-[1,2-phenylenebis(iminocarbonothioyl)]bis[carbamate]
 xref: CAS:23564-06-9;   KEGG:C18918;   PPDB:2935;   Pesticides:thiophanate;   Reaxys:939969


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19880
    role 19850
      chemical role 19479
        environmental contaminant 18858
          benzene 5817
            1,2-phenylenediamine 2587
              thiophanate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    main group molecular entity 19817
                      s-block molecular entity 19653
                        hydrogen molecular entity 19634
                          hydrides 19144
                            inorganic hydride 18161
                              pnictogen hydride 18151
                                nitrogen hydride 18064
                                  azane 17872
                                    ammonia 17871
                                      organic amino compound 17871
                                        polyamine 9025
                                          diamine 8960
                                            primary diamine 5705
                                              phenylenediamine 2680
                                                1,2-phenylenediamine 2587
                                                  benzimidazole precursor fungicide 25
                                                    thiophanate 0
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