300293 <common-name>3-(4-fluorophenyl)-4-[(e)-[(z)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-1h-1,2,4-triazole-5-thione</common-name> <description>3-(4-fluorophenyl)-4-[(e)-[(z)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-1h-1,2,4-triazole-5-thione belongs to the triazoles, a subclass of azoles within the organic compounds. This organoheterocyclic compound has the formula C16H13FN4OS and an average molecular weight of 328.40 g/mol.</description> <cas>676589-26-7</cas> <pubchem-id>6859151</pubchem-id> <chemical-formula>C16H13FN4OS</chemical-formula> <weight>328.4</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">2026-08-28T17:09:07Z</created-at> <updated-at type="dateTime">2026-08-28T17:09:07Z</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>CC(=CC1=CC=CO1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)F</moldb-smiles> <moldb-formula>C16H13FN4OS</moldb-formula> <moldb-inchi>InChI=1S/C16H13FN4OS/c1-11(9-14-3-2-8-22-14)10-18-21-15(19-20-16(21)23)12-4-6-13(17)7-5-12/h2-10H,1H3,(H,20,23)/b11-9-,18-10+</moldb-inchi> <moldb-inchikey>SCWINNPUTGVCOJ-GWNMMOMOSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">328.0794104</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.3</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>CHEM296186</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-fluorophenyl)-4-[(e)-[(z)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]-1h-1,2,4-triazole-5-thione</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>Azoles</klass> <subklass>Triazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0251570</sync-id> <structure-inchikey>SCWINNPUTGVCOJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20020002040000000000000000000000000000200000000000000000000000000008000000000002000000000000000000000002000200000000000008000000000000000000000000000808000000210000004000000000000001000110000018000000000000000800000000100000000000000000000400000000040000000800000280000200000800000000000000000400000000000000000000000000000400000080000002000000000000000000000000000000000000000000000080000000000000000020000000000042000022200000000002060020000000000000040000000000002800000000000000000080001000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������(�������h�������@(������@h�������@h�������@h�������@(�������h��������(������@(������@(������@(������@8�������@(�������(������@(������@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">2026-09-19T05:10:24Z</structure-indexed-at> </compound>