316354 <common-name>2-[4-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyrazine</common-name> <description>2-[4-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyrazine is a chemical compound with the formula C19H17N5S. It has an average molecular weight of 347.40 g/mol.</description> <cas>618427-48-8</cas> <pubchem-id>932823</pubchem-id> <chemical-formula>C19H17N5S</chemical-formula> <weight>347.4</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">2026-08-29T14:07:15Z</created-at> <updated-at type="dateTime">2026-08-29T14:07:15Z</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>CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4=NC=CN=C4</moldb-smiles> <moldb-formula>C19H17N5S</moldb-formula> <moldb-inchi>InChI=1S/C19H17N5S/c1-2-24-18(17-12-20-10-11-21-17)22-23-19(24)25-13-15-8-5-7-14-6-3-4-9-16(14)15/h3-12H,2,13H2,1H3</moldb-inchi> <moldb-inchikey>ZXUSTVLMAHMBTB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">347.1204667</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM312247</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-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyrazine</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>Benzenoids</superklass> <klass>Naphthalenes</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0267193</sync-id> <structure-inchikey>ZXUSTVLMAHMBTB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000800000000800000000000000000000000000000000000000000002000000000004000000002000000000000000000000000000000000000000000800000000000000000000000040000000000000000000000010002000000000200000000000200000000000000000000100000000000800000100000001000040010001800080000410000000080000008100000000000000000000100000000000000004040000080000000000000000480000000000000800000100000000040020041000000000000000000000000000002000000200010000000000000000000005002040000000000000000000000000004000000000800000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAHAAAAIABBgBgAAAAAQMGAGAAAAAC AgdAKAAAAAMDBkAoAAAAAwQHQCgAAAADAwdAKAAAAAMDBkAoAAAAAwQQACAA AAACBgBgAAAAAgIGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMD AQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMB BkAoAAAAAwQGQCgAAAADBAdAKAAAAAMDBkBoAAAAAwMBBkBoAAAAAwMBB0Ao AAAAAwMGQGgAAAADAwELAAEAAQIAAgNoDAMEaAwEBWgMBQZoDAYHAAcIAAgJ AAkKaAwKC2gMCwxoDAwNaAwNDmgMDg9oDA8QaAwQEWgMERJoDAMTIBMUaAwU FWgMFRZoDBYXaAwXGGgMBgJoDBIJaAwSDWgMGBNoDEIEAAAABQIDBAUGBgoL DA0SCQYODxAREg0GFBUWFxgTFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:22:27Z</structure-indexed-at> </compound>