334781 <common-name>2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(2,3-dimethylphenyl)acetamide</common-name> <description>2-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(2,3-dimethylphenyl)acetamide is a chemical compound with the formula C23H20BrN5OS. It has an average molecular weight of 494.40 g/mol.</description> <cas>477329-14-9</cas> <pubchem-id>1544148</pubchem-id> <chemical-formula>C23H20BrN5OS</chemical-formula> <weight>494.4</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">2026-08-30T16:37:36Z</created-at> <updated-at type="dateTime">2026-08-30T16:37:36Z</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>CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CN=CC=C4)C</moldb-smiles> <moldb-formula>C23H20BrN5OS</moldb-formula> <moldb-inchi>InChI=1S/C23H20BrN5OS/c1-15-5-3-7-20(16(15)2)26-21(30)14-31-23-28-27-22(17-6-4-12-25-13-17)29(23)19-10-8-18(24)9-11-19/h3-13H,14H2,1-2H3,(H,26,30)</moldb-inchi> <moldb-inchikey>RJANPIGFGNFQTP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">493.05719</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.8</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>CHEM330674</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-[[4-(4-bromophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-n-(2,3-dimethylphenyl)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>CED0285258</sync-id> <structure-inchikey>RJANPIGFGNFQTP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000200000800000000800000000000000000000000000004000084000000000000000000004008000002080000020000004000000000000000000000000000000000000000000000000000020000000000000000000808010000000000000010000000000000000000000000400000100000000000000000000000001100040000000800000000000000084880000010000000080000000000000000000000000000000000000080500000000000000410000000000002c00000100000000000020001002000100004000100000008000002000000200000000000000008040000000002040000000000400000008010000000041000000000000</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">2026-09-19T05:36:36Z</structure-indexed-at> </compound>