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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-[5-[2-(tert-butylamino)-4H-1,3,4-thiadiazin-5-ylidene]-2,4-dimethyl-3-pyrrolyl]ethanone
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Accession:CHEBI:121901 term browser browse the term
Definition:A ketone that has formula C15H22N4OS.
Synonyms:related_synonym: Formula=C15H22N4OS;   InChI=1S/C15H22N4OS/c1-8-12(10(3)20)9(2)16-13(8)11-7-21-14(19-18-11)17-15(4,5)6/h18H,7H2,1-6H3,(H,17,19);   InChIKey=XHDPLVKOCUSBPS-UHFFFAOYSA-N;   SMILES=CC1=C(C(=NC1=C2CSC(=NN2)NC(C)(C)C)C)C(=O)C
 xref: LINCS:LSM-33344


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              carbonyl compound 0
                ketone 0
                  1-[5-[2-(tert-butylamino)-4H-1,3,4-thiadiazin-5-ylidene]-2,4-dimethyl-3-pyrrolyl]ethanone 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      1-[5-[2-(tert-butylamino)-4H-1,3,4-thiadiazin-5-ylidene]-2,4-dimethyl-3-pyrrolyl]ethanone 0
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