<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">320843</id>
  <title nil="true"/>
  <common-name>N-[(4-phenylphenyl)carbamothioyl]benzamide</common-name>
  <description>N-[(4-phenylphenyl)carbamothioyl]benzamide is a chemical compound with the formula C20H16N2OS. It has an average molecular weight of 332.40 g/mol.</description>
  <cas>6281-71-6</cas>
  <pubchem-id>3034180</pubchem-id>
  <chemical-formula>C20H16N2OS</chemical-formula>
  <weight>332.4</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">2026-08-29T19:59:21Z</created-at>
  <updated-at type="dateTime">2026-08-29T19:59:21Z</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>C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3</moldb-smiles>
  <moldb-formula>C20H16N2OS</moldb-formula>
  <moldb-inchi>InChI=1S/C20H16N2OS/c23-19(17-9-5-2-6-10-17)22-20(24)21-18-13-11-16(12-14-18)15-7-3-1-4-8-15/h1-14H,(H2,21,22,23,24)</moldb-inchi>
  <moldb-inchikey>XVAQOLJMMPBKGC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">332.0983343</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.6</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>CHEM316736</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>N-[(4-phenylphenyl)carbamothioyl]benzamide</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>N-phenylthioureas</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0271572</sync-id>
  <structure-inchikey>XVAQOLJMMPBKGC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40020000000000000000000100000000000000000000000000000000000000000000000004000000000000000000000002000000000000000000000000000000000000000020000000000000000000008000000000000000010000000010000000000000800000002000000000000000000000000000000000000400800000010000000080800000000100000000000000000000000000000000000000000000084000000000000800000000000000000000000002000000000000000000000000000000400000000000000000000200000000000000008000000000004040000000000400000000008800004000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAYAAAAGgAAAIABBkBoAAAAAwMBBkBoAAAA
AwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAAD
BAZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB
BwBoAAAAAwIBBgAoAAAAAwQQACgAAAADAgcAaAAAAAMCAQYAKAAAAAMECAAo
AAAAAwIGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAA
AAMDAQZAaAAAAAMDAQsAAWgMAQJoDAIDaAwDBGgMBAVoDAMGIAYHaAwHCGgM
CAloDAkKaAwKC2gMCQwgDA0gDQ4oAg0PIA8QIBARKAIQEiASE2gMExRoDBQV
aAwVFmgMFhdoDAUAaAwLBmgMFxJoDEIDAAAABgAFBAMCAQYHCAkKCwYGExQV
FhcSFwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:25:52Z</structure-indexed-at>
</compound>
