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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:1,4-diamino-2,3-dicyano-1,4-bis(phenylthio)butadiene
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Accession:CHEBI:75389 term browser browse the term
Definition:A dinitrile that is succinonitrile in which the methylene hydrogens at positions 2 and 3 are substituted by amino(phenylsulfanyl)methylidene groups. It acts as an inhibitor of MEK (mitogen activated protein kinase kinase).
Synonyms:exact_synonym: (2Z,3Z)-bis[amino(phenylsulfanyl)methylidene]butanedinitrile
 related_synonym: Formula=C18H14N4S2;   InChI=1S/C18H14N4S2/c19-11-15(17(21)23-13-7-3-1-4-8-13)16(12-20)18(22)24-14-9-5-2-6-10-14/h1-10H,21-22H2/b17-15+,18-16+;   InChIKey=BDLRGKKVJJEYLC-YTEMWHBBSA-N;   SMILES=N\\C(Sc1ccccc1)=C(C#N)/C(C#N)=C(\\N)Sc1ccccc1;   U0125
 xref: PMID:12121979;   PMID:12694865;   Reaxys:8073563



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Term Annotations click to browse term
  CHEBI ontology 20089
    role 20042
      biological role 20011
        aetiopathogenetic role 19302
          carcinogenic agent 18554
            buta-1,3-diene 2067
              1,4-diamino-2,3-dicyano-1,4-bis(phenylthio)butadiene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20089
    subatomic particle 20058
      composite particle 20058
        hadron 20088
          baryon 20088
            nucleon 20088
              atomic nucleus 20088
                atom 20058
                  main group element atom 19960
                    main group molecular entity 19960
                      s-block molecular entity 19784
                        hydrogen molecular entity 19777
                          hydrides 19115
                            inorganic hydride 17901
                              pnictogen hydride 17884
                                nitrogen hydride 17773
                                  azane 17503
                                    ammonia 17521
                                      organic amino compound 17521
                                        amine 7919
                                          enamine 29
                                            1,4-diamino-2,3-dicyano-1,4-bis(phenylthio)butadiene 0
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