333915 <common-name>N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide</common-name> <description>N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide is a chemical compound with the formula C23H14ClF6N5OS. With an average molecular weight of 557.90 g/mol, N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide is a heavy molecule.</description> <cas>618880-42-5</cas> <pubchem-id>3841771</pubchem-id> <chemical-formula>C23H14ClF6N5OS</chemical-formula> <weight>557.9</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">2026-08-30T15:29:02Z</created-at> <updated-at type="dateTime">2026-08-30T15:29:02Z</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(=CC=C1N2C(=NN=C2SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=NC=C4)Cl</moldb-smiles> <moldb-formula>C23H14ClF6N5OS</moldb-formula> <moldb-inchi>InChI=1S/C23H14ClF6N5OS/c24-16-1-3-18(4-2-16)35-20(13-5-7-31-8-6-13)33-34-21(35)37-12-19(36)32-17-10-14(22(25,26)27)9-15(11-17)23(28,29)30/h1-11H,12H2,(H,32,36)</moldb-inchi> <moldb-inchikey>QHDJVYJYWKQBOS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">557.0511779</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.8</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>CHEM329808</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>N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]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>Organoheterocyclic compounds</superklass> <klass>Pyridines and derivatives</klass> <subklass>Pyridyltriazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284394</sync-id> <structure-inchikey>QHDJVYJYWKQBOS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000200000880000002800000000000000000100000080004000000000000000000000000004008000002180000000000000000000000000200000000000000080400000000000000000000020000000000000000000000010000000000000014080000000000000100000050000000100000000000002000000000000000000020000000000000000000082880000010000800000000000080000000000000000000000000000080000000040000000450000000000002c00000000000000000000001000000000000000000010000000002000000200000000000000008040000000002040000000000400800000010000000040000000000000</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�B��������������� ��������� !"#�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:35:53Z</structure-indexed-at> </compound>