334402 <common-name>2-[[5-(anilinomethyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone</common-name> <description>2-[[5-(anilinomethyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone is a chemical compound with the formula C23H18Cl2N4OS. It has an average molecular weight of 469.40 g/mol.</description> <cas>618441-35-3</cas> <pubchem-id>3842048</pubchem-id> <chemical-formula>C23H18Cl2N4OS</chemical-formula> <weight>469.4</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">2026-08-30T16:05:11Z</created-at> <updated-at type="dateTime">2026-08-30T16:05:11Z</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>C1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)C4=CC=C(C=C4)Cl</moldb-smiles> <moldb-formula>C23H18Cl2N4OS</moldb-formula> <moldb-inchi>InChI=1S/C23H18Cl2N4OS/c24-17-8-6-16(7-9-17)21(30)15-31-23-28-27-22(14-26-19-4-2-1-3-5-19)29(23)20-12-10-18(25)11-13-20/h1-13,26H,14-15H2</moldb-inchi> <moldb-inchikey>PMEBCWNWQSTVKQ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">468.0578378</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.1</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>CHEM330295</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-(anilinomethyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone</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 oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284880</sync-id> <structure-inchikey>PMEBCWNWQSTVKQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>220000810000000800000000000000000100000080004000010000000000008002000004000000002084000000000000000000000000000000000000000000400000000000000000000020000000000001000000000010000000000000010080000000000400000002000000000100000000000800000000000000000000020000800000004000000080080000000100000000000000000000000000000000000000000000084000000080000000400000000000000400000000000000000000000000200000000000000010044000000000000200000000000000000040000000000040000000000408000000010000000040000000000000</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��� ������� h� h� �h���h�� �h���h���h���h���h���������������(��� ��h���h���h���h���h������h���h�� h���h�B������������ ��� ������ �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:36:15Z</structure-indexed-at> </compound>