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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 19831
    role 19807
      chemical role 19442
        environmental contaminant 18846
          benzene 5795
            1,2-phenylenediamine 2587
              thiophanate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    main group molecular entity 19779
                      s-block molecular entity 19617
                        hydrogen molecular entity 19604
                          hydrides 19102
                            inorganic hydride 18114
                              pnictogen hydride 18103
                                nitrogen hydride 18010
                                  azane 17819
                                    ammonia 17818
                                      organic amino compound 17818
                                        polyamine 9026
                                          diamine 8961
                                            primary diamine 5705
                                              phenylenediamine 2680
                                                1,2-phenylenediamine 2587
                                                  benzimidazole precursor fungicide 25
                                                    thiophanate 0
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