335328 <common-name>3-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine</common-name> <description>3-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine is a chemical compound with the formula C23H22N4OS. It has an average molecular weight of 402.50 g/mol.</description> <cas>477330-16-8</cas> <pubchem-id>1386899</pubchem-id> <chemical-formula>C23H22N4OS</chemical-formula> <weight>402.5</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">2026-08-30T17:27:31Z</created-at> <updated-at type="dateTime">2026-08-30T17:27:31Z</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>CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C4=CN=CC=C4</moldb-smiles> <moldb-formula>C23H22N4OS</moldb-formula> <moldb-inchi>InChI=1S/C23H22N4OS/c1-3-28-21-12-10-20(11-13-21)27-22(18-9-6-14-24-15-18)25-26-23(27)29-16-19-8-5-4-7-17(19)2/h4-15H,3,16H2,1-2H3</moldb-inchi> <moldb-inchikey>DMMGAUKSJIZDJX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">402.1514325</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.7</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>CHEM331221</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>3-[4-(4-ethoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine</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>CED0285802</sync-id> <structure-inchikey>DMMGAUKSJIZDJX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200400800002000800000000000000000000000000004400004000000002000000200004008000002000000000000004000000000000000000040000000000000000000000000000000000000000000100000200008010002000000000000000000000000000000000000000000100000000000002000000000000100040000000800000000000000000880000010100000000020000000000100000000000000004000000080100000000000000480000000000000c00000100000000000020041000000000000000100000000000002000000200000000000000000040000000002040000000000000000000000000000041000000800000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAIAAAAIABBgBgAAAAAQMGAGAAAAAC AggAKAAAAAMCBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAADBAZA aAAAAAMDAQZAaAAAAAMDAQdAKAAAAAMDBkAoAAAAAwQHQCgAAAADAwdAKAAA AAMDBkAoAAAAAwQQACAAAAACBgBgAAAAAgIGQCgAAAADBAZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBgBgAAAAAQMGQCgA AAADBAZAaAAAAAMDAQdAKAAAAAMDBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAA AwMBCwABAAECAAIDIAMEaAwEBWgMBQZoDAYHaAwHCGgMBgkgCQpoDAoLaAwL DGgMDA1oDA0OAA4PAA8QABARaAwREmgMEhNoDBMUaAwUFWgMFRYAChcgFxho DBgZaAwZGmgMGhtoDBscaAwIA2gMDQloDBUQaAwcF2gMQgQAAAAGAwgHBgUE BQsKCQ0MBhESExQVEAYYGRobHBcXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:37:02Z</structure-indexed-at> </compound>