316666 <common-name>4-(2-methoxyphenyl)-3-[(2-methyl-1h-indol-3-yl)methyl]-1h-1,2,4-triazole-5-thione</common-name> <description>4-(2-methoxyphenyl)-3-[(2-methyl-1h-indol-3-yl)methyl]-1h-1,2,4-triazole-5-thione is a chemical compound with the formula C19H18N4OS. It has an average molecular weight of 350.40 g/mol.</description> <cas>54649-01-3</cas> <pubchem-id>3041668</pubchem-id> <chemical-formula>C19H18N4OS</chemical-formula> <weight>350.4</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">2026-08-29T14:28:25Z</created-at> <updated-at type="dateTime">2026-08-29T14:28:25Z</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(C2=CC=CC=C2N1)CC3=NNC(=S)N3C4=CC=CC=C4OC</moldb-smiles> <moldb-formula>C19H18N4OS</moldb-formula> <moldb-inchi>InChI=1S/C19H18N4OS/c1-12-14(13-7-3-4-8-15(13)20-12)11-18-21-22-19(25)23(18)16-9-5-6-10-17(16)24-2/h3-10,20H,11H2,1-2H3,(H,22,25)</moldb-inchi> <moldb-inchikey>VEAXWCJEAAUBNS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">350.1201324</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.6</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>CHEM312559</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>4-(2-methoxyphenyl)-3-[(2-methyl-1h-indol-3-yl)methyl]-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>CED0267500</sync-id> <structure-inchikey>VEAXWCJEAAUBNS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20800040000104000000000010000000000200000000400000000000000002000000000000002000000000000800000808000000000000000000000000000000000000000000000000000000000900000000000000000000000000000000000040000000000000000000000100000000000000000000000000000040000000800000200000000000000040000100002000000080000000000110000000000000040000080000002000020000000000000000000000000080000000040000000000000000010000000000000000042000024200000001000040000000000000000040000000000000001000008020000040080000002000</structure-fingerprint> <structure-pattern-fingerprint>501742100932824081000b6081282100018014008505220400352041822089cc54222010128000001100410800c00000046002a4c08c32410026647100a04040c7110c001290060020905000037202840854059053211b3240040c62502241061c2805270048a20068028400cd940201208680708119c09c5119286802510012124c41084ef08208080612508aac0008393c8812448014831022082020c000a650c310101090c2000a000960017c2d100ac000028943084818a042100cc04238804010a404d01a3305800400141112800c010000024050200d12020408000300901048100889020400020413d3522000081000308042040e4108100052101442</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAHAAAAIABBgBgAAAAAQMGQCgAAAAD BAZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QGgAAAADAwEGQCgAAAADBAdAOAAAAAMBAwYAYAAAAAICBkAoAAAAAwQHQCgA AAADAwdAOAAAAAMBAwZAKAAAAAMEEAAoAAAAAwIHQCgAAAADAwZAKAAAAAME BkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQI ACgAAAADAgYAYAAAAAEDCwABAAECaAwCA2gMAwRoDAQFaAwFBmgMBgdoDAcI aAwICWgMAgoACgsACwxoDAwNaAwNDmgMDg8oAg4QaAwQESAREmgMEhNoDBMU aAwUFWgMFRZoDBYXIBcYAAkBaAwIA2gMEAtoDBYRaAxCBAAAAAUBAgMICQYE BQYHCAMFDAsQDg0GEhMUFRYRFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:22:41Z</structure-indexed-at> </compound>