329983 <common-name>N-(4-bromo-2-methylphenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide</common-name> <description>N-(4-bromo-2-methylphenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide is a chemical compound with the formula C22H17BrClN5OS. With an average molecular weight of 514.80 g/mol, N-(4-bromo-2-methylphenyl)-2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide is a heavy molecule.</description> <cas>476483-89-3</cas> <pubchem-id>1544110</pubchem-id> <chemical-formula>C22H17BrClN5OS</chemical-formula> <weight>514.8</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">2026-08-30T10:26:15Z</created-at> <updated-at type="dateTime">2026-08-30T10:26:15Z</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)Br)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=NC=C4</moldb-smiles> <moldb-formula>C22H17BrClN5OS</moldb-formula> <moldb-inchi>InChI=1S/C22H17BrClN5OS/c1-14-12-16(23)2-7-19(14)26-20(30)13-31-22-28-27-21(15-8-10-25-11-9-15)29(22)18-5-3-17(24)4-6-18/h2-12H,13H2,1H3,(H,26,30)</moldb-inchi> <moldb-inchikey>CHVXWLLAEPBLOM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">513.00257</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.1</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>CHEM325876</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-(4-bromo-2-methylphenyl)-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>CED0280540</sync-id> <structure-inchikey>CHVXWLLAEPBLOM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000200000800000000800000000000000000000000080004000000000000000080000000004008000002180000000000000000000000000200000000000000080400000000000000000000020000000000000000000800010000200000000010080000000000000100000000400000100000000000000000000000000000040020000000000000000000084880000010000800080000000000000000040000000000000000000080100000000000020410000000000002c00000000000000000000001000000100000000000010000000002000000200000000000000008040000000802040000000000400000008010000000040000000000000</structure-fingerprint> <structure-pattern-fingerprint>5014c0008d12864081001b408128a1000000140087052000003d20c28224094c4c02285c139000001100410802c0008204600224c08d32090024743104a04090d7110c0012900418009010c0007202800805059053213b3340040462400248000c29052f0048122060000400d594024c208280700101c18c7118086002710002104821184ef082080c0602544aac0018391d0a1244401c8250000820604060a4c04730108090c00000000960057c37100ac200028941084018204a1008c00272a04012a424d0123205808404541512900c010000420050200d72020408000300901040100ac9004011020011d51320820050003080c2040e0108108072100606</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">2026-09-19T05:32:39Z</structure-indexed-at> </compound>