<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">338597</id>
  <title nil="true"/>
  <common-name>2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-n-(4-phenoxyphenyl)acetamide</common-name>
  <description>2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-n-(4-phenoxyphenyl)acetamide is a chemical compound with the formula C24H21N3O3S3. It has an average molecular weight of 495.60 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3827799</pubchem-id>
  <chemical-formula>C24H21N3O3S3</chemical-formula>
  <weight>495.6</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">2026-08-30T21:43:36Z</created-at>
  <updated-at type="dateTime">2026-08-30T21:43:36Z</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>COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4</moldb-smiles>
  <moldb-formula>C24H21N3O3S3</moldb-formula>
  <moldb-inchi>InChI=1S/C24H21N3O3S3/c1-29-19-11-7-17(8-12-19)15-31-23-26-27-24(33-23)32-16-22(28)25-18-9-13-21(14-10-18)30-20-5-3-2-4-6-20/h2-14H,15-16H2,1H3,(H,25,28)</moldb-inchi>
  <moldb-inchikey>YTXKVIBQQBUMLX-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">495.0745051</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6</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>CHEM334490</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>2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-n-(4-phenoxyphenyl)acetamide</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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Diphenylethers</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0289024</sync-id>
  <structure-inchikey>YTXKVIBQQBUMLX-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800000000800000000002000000140000000000000000000000000000200200004000000002004000000000000000001000000000000000000000000200000000000000100000020000010000100000200000000002000040004010000010050000000000000040000000000000000000000010100000000000040000400800000000000000080080000000100000000000008020000000000000000000000000000080000000200000000010000000000002000000080000001000000000000400000000000000000000000000000000220000000000000008000000000000040000000000400000000010000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������!���$���€���`�������(������@(������@h�������@h�������@(������@h�������@h��������`������� �����@(������@(������@(������@(������@(������� ������`�������(�������(�������h�������@(������@h�������@h�������@(������@h�������@h��������(������@(������@h�������@h�������@h�������@h�������@h������������ ��h���h���h���h���h�����	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:39:19Z</structure-indexed-at>
</compound>
