317938 <common-name>(2,2-dimethyl-3h-1-benzofuran-7-yl) n-(4-methoxyphenyl)sulfanyl-n-methylcarbamate</common-name> <description>(2,2-dimethyl-3h-1-benzofuran-7-yl) n-(4-methoxyphenyl)sulfanyl-n-methylcarbamate is a chemical compound with the formula C19H21NO4S. It has an average molecular weight of 359.40 g/mol.</description> <cas>50479-95-3</cas> <pubchem-id>39678</pubchem-id> <chemical-formula>C19H21NO4S</chemical-formula> <weight>359.4</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">2026-08-29T16:08:47Z</created-at> <updated-at type="dateTime">2026-08-29T16:08:47Z</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(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC=C(C=C3)OC)C</moldb-smiles> <moldb-formula>C19H21NO4S</moldb-formula> <moldb-inchi>InChI=1S/C19H21NO4S/c1-19(2)12-13-6-5-7-16(17(13)24-19)23-18(21)20(3)25-15-10-8-14(22-4)9-11-15/h5-11H,12H2,1-4H3</moldb-inchi> <moldb-inchikey>ZTWQRJRDZNARHT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">359.1191293</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.5</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>CHEM313831</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>(2,2-dimethyl-3h-1-benzofuran-7-yl) n-(4-methoxyphenyl)sulfanyl-n-methylcarbamate</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>Coumarans</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0268747</sync-id> <structure-inchikey>ZTWQRJRDZNARHT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000000802000000000000000000000000000000000000000000000000200000040000000000000000000000000000000000000000000000000000000000000000000000000020880000000100000200000000000000040000011000010040000000004000000000020008000000000000000000000001000048000000800080000000000080100800000000000000080001010020200200000020000000000000080000002000008000000000002000800000000080000000000004000000000000000000000000000008000040000200000000000000000000000000000041000100000400000000000020000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAGwAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAgIGQCgAAAADBAZAKAAAAAMECAAoAAAAAwIGQCgAAAADBAZAaAAA AAMDAQZAaAAAAAMDAQZAaAAAAAMDAQgAKAAAAAMCBgAoAAAAAwQIACgAAAAD AgcAKAAAAAMDBgBgAAAAAQMQACAAAAACBkAoAAAAAwQGQGgAAAADAwEGQGgA AAADAwEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQgAKAAAAAMCBgBgAAAA AQMGAGAAAAABAwsAAQABAgACAwADBGgMBAUgBAZoDAYHaAwHCGgMCAloDAYK IAoLIAsMKAILDSANDgANDwAPEAAQEWgMERJoDBITaAwTFGgMFBVoDBMWIBYX AAEYAAUBAAkDaAwVEGgMQgMAAAAFAQIDBAUGBwgJAwQGBhESExQVEBcEAAAA AAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:23:37Z</structure-indexed-at> </compound>