326477 <common-name>1-(2,4-dimethylphenyl)-3-[(2-naphthalen-1-ylacetyl)amino]thiourea</common-name> <description>1-(2,4-dimethylphenyl)-3-[(2-naphthalen-1-ylacetyl)amino]thiourea is a compound with the formula C21H21N3OS. It has an average molecular weight of 363.50 g/mol.</description> <cas>56987-49-6</cas> <pubchem-id>3033136</pubchem-id> <chemical-formula>C21H21N3OS</chemical-formula> <weight>363.5</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">2026-08-30T04:47:34Z</created-at> <updated-at type="dateTime">2026-08-30T04:47:34Z</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=CC(=C(C=C1)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32)C</moldb-smiles> <moldb-formula>C21H21N3OS</moldb-formula> <moldb-inchi>InChI=1S/C21H21N3OS/c1-14-10-11-19(15(2)12-14)22-21(26)24-23-20(25)13-17-8-5-7-16-6-3-4-9-18(16)17/h3-12H,13H2,1-2H3,(H,23,25)(H2,22,24,26)</moldb-inchi> <moldb-inchikey>QFIVNADDYPJUCI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">363.1405335</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM322370</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>1-(2,4-dimethylphenyl)-3-[(2-naphthalen-1-ylacetyl)amino]thiourea</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>CED0277096</sync-id> <structure-inchikey>QFIVNADDYPJUCI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1004000000000800040020000000000000000000000084000001000010000004000000000040000000000000000000000000000000010000000000000000000000000000000000000000000000060000000000000000000000040000000000000010000000000000000100000000000004000000000000000000004000001000040000001800080000000000080000000000100000080000000000000000040000000000804040000080100000000000820000000000000000000000000000000040000040000000000000000000000000000002000000200000000000000008100000001800040000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAaAAAAHAAAAIABBgBgAAAAAQMGQCgAAAAD BAZAaAAAAAMDAQZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEH AGgAAAADAgEGACgAAAADBBAAKAAAAAMCBwBoAAAAAwIBBwBoAAAAAwIBBgAo AAAAAwQIACgAAAADAgYAYAAAAAICBkAoAAAAAwQGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMD AQZAaAAAAAMDAQZAKAAAAAMEBgBgAAAAAQMLAAEAAQJoDAIDaAwDBGgMBAVo DAUGaAwEByAHCCAICSgCCAogCgsACwwgDA0oAgwOAA4PAA8QaAwQEWgMERJo DBITaAwTFGgMFBVoDBUWaAwWF2gMFxhoDAMZAAYBaAwYD2gMGBNoDEIDAAAA BgEGBQQDAgYQERITGA8GFBUWFxgTFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:30:06Z</structure-indexed-at> </compound>