364721 <common-name>Methyl n-(phenylcarbamothioylamino)carbamodithioate</common-name> <description>Methyl n-(phenylcarbamothioylamino)carbamodithioate is a compound with the formula C9H11N3S3. It has an average molecular weight of 257.40 g/mol.</description> <cas>387361-80-0</cas> <pubchem-id>3801848</pubchem-id> <chemical-formula>C9H11N3S3</chemical-formula> <weight>257.4</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">2026-09-01T14:58:00Z</created-at> <updated-at type="dateTime">2026-09-01T14:58:00Z</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>CSC(=S)NNC(=S)NC1=CC=CC=C1</moldb-smiles> <moldb-formula>C9H11N3S3</moldb-formula> <moldb-inchi>InChI=1S/C9H11N3S3/c1-15-9(14)12-11-8(13)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,12,14)(H2,10,11,13)</moldb-inchi> <moldb-inchikey>ARTKXMLZMMMHHY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">257.0115109</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.6</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>CHEM360614</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>Methyl n-(phenylcarbamothioylamino)carbamodithioate</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>Benzene and substituted derivatives</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0314697</sync-id> <structure-inchikey>ARTKXMLZMMMHHY-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000000000000040020800000000000000000100000000000010000000000000000000000000000000000004200000000000000000000000000000000000000000000000000000004000000000000000000001000000000040000000000000010000000000000000000000000000000000000000000000000000000000000040000400800000000000000080000000000100000000000000000000000000000000000800000000080000040000004800000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000008000000000000040000000000000000000008000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAADwAAAIABBgBgAAAAAQMQACAAAAAC BgAoAAAAAwQQACgAAAADAgcAaAAAAAMCAQcAaAAAAAMCAQYAKAAAAAMEEAAo AAAAAwIHAGgAAAADAgEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAA AAMDAQZAaAAAAAMDAQZAaAAAAAMDAQsAAQABAgACAygCAgQgBAUABQYgBgco AgYIIAgJIAkKaAwKC2gMCwxoDAwNaAwNDmgMDgloDEIBAAAABgkODQwLChcE AAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:02Z</structure-indexed-at> </compound>