<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">312319</id>
  <title nil="true"/>
  <common-name>3-(4-ethoxyphenyl)-4-[(2e)-2-[(4-methylphenyl)methylidene]hydrazinyl]-1h-1,2,4-triazole-5-thione</common-name>
  <description>3-(4-ethoxyphenyl)-4-[(2e)-2-[(4-methylphenyl)methylidene]hydrazinyl]-1h-1,2,4-triazole-5-thione is a chemical compound with the formula C18H19N5OS. It has an average molecular weight of 353.40 g/mol.</description>
  <cas>624724-99-8</cas>
  <pubchem-id>16447990</pubchem-id>
  <chemical-formula>C18H19N5OS</chemical-formula>
  <weight>353.4</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">2026-08-29T08:40:56Z</created-at>
  <updated-at type="dateTime">2026-08-29T08:40:56Z</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>CCOC1=CC=C(C=C1)C2=NNC(=S)N2NN=CC3=CC=C(C=C3)C</moldb-smiles>
  <moldb-formula>C18H19N5OS</moldb-formula>
  <moldb-inchi>InChI=1S/C18H19N5OS/c1-3-24-16-10-8-15(9-11-16)17-20-21-18(25)23(17)22-19-12-14-6-4-13(2)5-7-14/h4-12,22H,3H2,1-2H3,(H,21,25)/b19-12+</moldb-inchi>
  <moldb-inchikey>ZQZMVKMHLRLOFB-XDHOZWIPSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">353.1310314</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <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>CHEM308212</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>3-(4-ethoxyphenyl)-4-[(2e)-2-[(4-methylphenyl)methylidene]hydrazinyl]-1h-1,2,4-triazole-5-thione</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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0263259</sync-id>
  <structure-inchikey>ZQZMVKMHLRLOFB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000420800042000000000000000000000000000200001400000002000102000400200000000000002000000000000000000000000000200000000000000000000000000000000000000000000020000300000204000000000000000000000000010000000080000000800000000100000000000000000000000000000040000000000000200000000080800000000000020000020000000000000000000000000000000000080000000000000000080000000000000000000000000000000000000000000000000008000000000000042000800200000000000041000100000000001040000000000080000000000000000010080000004000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(������@(������@h�������@h�������@(������@h�������@h�������@(������@(������@8�������@(�������(������@(�������h��������(�������h�������@(������@h�������@h�������@(������@h�������@h��������`�������������� ��h���h���h���h���h��	 	
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	��������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:19:17Z</structure-indexed-at>
</compound>
