9413 <common-name>Diclocymet I</common-name> <description nil="true"/> <cas>139920-32-4</cas> <pubchem-id>11527333</pubchem-id> <chemical-formula>C15H18Cl2N2O</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2016-05-19T02:43:24Z</created-at> <updated-at type="dateTime">2026-04-03T09:40:36Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC(N=C(O)C(C#N)C(C)(C)C)C1=C(Cl)C=C(Cl)C=C1</moldb-smiles> <moldb-formula>C15H18Cl2N2O</moldb-formula> <moldb-inchi>InChI=1S/C15H18Cl2N2O/c1-9(11-6-5-10(16)7-13(11)17)19-14(20)12(8-18)15(2,3)4/h5-7,9,12H,1-4H3,(H,19,20)</moldb-inchi> <moldb-inchikey>YEJGPFZQLRMXOI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">313.22</moldb-average-mass> <moldb-mono-mass type="decimal">312.0796186</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>9635970</chemspider-id> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM008308</chemdb-id> <dsstox-id>DTXSID4057970</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00021638</susdat-id> <iupac>2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanimidic acid</iupac> </compound>