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<compound>
  <id type="integer">346287</id>
  <title nil="true"/>
  <common-name>Ethyl 2-[[2-[(2e)-2-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate</common-name>
  <description>Ethyl 2-[[2-[(2e)-2-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is a chemical compound with the formula C27H26ClN3O5S. With an average molecular weight of 540.00 g/mol, Ethyl 2-[[2-[(2e)-2-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate is a heavy molecule.</description>
  <cas>881464-56-8</cas>
  <pubchem-id>51060297</pubchem-id>
  <chemical-formula>C27H26ClN3O5S</chemical-formula>
  <weight>540</weight>
  <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">2026-08-31T09:41:22Z</created-at>
  <updated-at type="dateTime">2026-08-31T09:41:22Z</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>CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=O)NN=CC3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl</moldb-smiles>
  <moldb-formula>C27H26ClN3O5S</moldb-formula>
  <moldb-inchi>InChI=1S/C27H26ClN3O5S/c1-2-35-27(34)23-21-5-3-4-6-22(21)37-26(23)30-24(32)25(33)31-29-15-17-9-13-20(14-10-17)36-16-18-7-11-19(28)12-8-18/h7-15H,2-6,16H2,1H3,(H,30,32)(H,31,33)/b29-15+</moldb-inchi>
  <moldb-inchikey>HRLCTZGCZAHFLM-WKULSOCRSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">539.1281698</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.5</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <structure-image-content-type nil="true"/>
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  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM342180</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>Ethyl 2-[[2-[(2e)-2-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]hydrazinyl]-2-oxoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0296640</sync-id>
  <structure-inchikey>HRLCTZGCZAHFLM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400020220000008000021000000000500020000000000000880000000000020000020006022000000040400000000000000000000000000000000000000000000000004000002000000000000000220000100003000002040000400100000000000180800000000000800000000000000a000000000200000000000000080000004002000000000000000000008000000000000020000002000000000000000000000000000000000008010000000000000008000000000000000000000000000000010000000002000000000000001000000000200020022000200000000000c000400000001040000000000400000000000000000000000000004020</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T05:45:03Z</structure-indexed-at>
</compound>
