335262 <common-name>[4-[(e)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] (e)-3-(4-tert-butylphenyl)prop-2-enoate</common-name> <description>[4-[(e)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] (e)-3-(4-tert-butylphenyl)prop-2-enoate is a chemical compound with the formula C23H22N2O3S. It has an average molecular weight of 406.50 g/mol.</description> <cas>518350-06-6</cas> <pubchem-id>45054298</pubchem-id> <chemical-formula>C23H22N2O3S</chemical-formula> <weight>406.5</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">2026-08-30T17:21:18Z</created-at> <updated-at type="dateTime">2026-08-30T17:21:18Z</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(C)(C)C1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)C=C3C(=O)N=C(S3)N</moldb-smiles> <moldb-formula>C23H22N2O3S</moldb-formula> <moldb-inchi>InChI=1S/C23H22N2O3S/c1-23(2,3)17-9-4-15(5-10-17)8-13-20(26)28-18-11-6-16(7-12-18)14-19-21(27)25-22(24)29-19/h4-14H,1-3H3,(H2,24,25,27)/b13-8+,19-14+</moldb-inchi> <moldb-inchikey>QOIFDBXJJMGWRX-MZZBYLLYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">406.1351137</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.4</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>CHEM331155</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-[(e)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] (e)-3-(4-tert-butylphenyl)prop-2-enoate</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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0285736</sync-id> <structure-inchikey>QOIFDBXJJMGWRX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>41400000000000000000002000002000020000800000000000000000000000404000000020200000000000002000800000000800000000000000000000000000000000010000000000000000000020000010000300000200000000000000000001010000001000001000020000000000010000000000000000000000001000000040004000000000000000000000001000000000000000000000000000000000080000001000004000080000800040000002004000000000000000000000000800000000000000000000000000400000000000000040000200000400000000000000000000000040000000000400000000000000000000000000004008</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAHwAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMGAGAAAAABAwZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkAo AAAAAwQGQGgAAAADAwEGQGgAAAADAwEGAGgAAAADAwEGAGgAAAADAwEGACgA AAADBAgAKAAAAAMCCAAoAAAAAwIGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMD AQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBgBoAAAAAwMBBgAoAAAAAwQG ACgAAAADBAgAKAAAAAMCBwAoAAAAAwMGACgAAAADBBAAIAAAAAIHAGgAAAAD AQILAAEAAQIAAQMAAQQABAVoDAUGaAwGB2gMBwhoDAgJaAwHCiAKCygCCwwg DA0oAgwOIA4PIA8QaAwQEWgMERJoDBITaAwTFGgMEhUgFRYoAhYXIBcYKAIX GSAZGigCGhsAGhwgCQRoDBQPaAwbFgBCAwAAAAYECQgHBgUGEBESExQPBRcW GxoZFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:36:57Z</structure-indexed-at> </compound>