<?xml version="1.0" encoding="UTF-8"?>
<compound>
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  <title nil="true"/>
  <common-name>2-(diethylamino)-n-(4-phenylsulfanylphenyl)acetamide</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>53730</pubchem-id>
  <chemical-formula>C18H22N2OS</chemical-formula>
  <weight>314.4</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">2026-08-29T10:07:18Z</created-at>
  <updated-at type="dateTime">2026-08-29T10:07:18Z</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>CCN(CC)CC(=O)NC1=CC=C(C=C1)SC2=CC=CC=C2</moldb-smiles>
  <moldb-formula>C18H22N2OS</moldb-formula>
  <moldb-inchi>InChI=1S/C18H22N2OS/c1-3-20(4-2)14-18(21)19-15-10-12-17(13-11-15)22-16-8-6-5-7-9-16/h5-13H,3-4,14H2,1-2H3,(H,19,21)</moldb-inchi>
  <moldb-inchikey>FIYPHPXOBJSCJJ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">314.1452845</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>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>CHEM309260</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-(diethylamino)-n-(4-phenylsulfanylphenyl)acetamide</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>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0264278</sync-id>
  <structure-inchikey>FIYPHPXOBJSCJJ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>10004000000000800000000800000000000000000100000000000000100008010002000000000000000000000004000000000000000000000000000000000000000080000000000000000000000020000000000000000000000000000000000000011000000010000000004000040000000820000000000000000000000000000040000400800000000000000080000000020100000000000001000000000000000000000000000000080000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000200000000000020008000000000000040000000000400000000000000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>411000000913044080000900010820000000040000052000003100400200000c4002005000800000000041000080000004200025c08c30010020643000a04000c6110c00020004000090100000620000000401804001003240400422000248000c200406004002000000040054140000200080500101c0047118000002710002004000180ce080080c020240082c0008111c08124c4014020000080000404080404310000010c00000000940057c25100ac00000884108401000020000c00210001000842448000201800004040102800000000002004000090000000800020000000110100000000000000040022000001000308042000e0008008050000406</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������(�������(�������h�������@(������@h�������@h�������@(������@h�������@h�������� �����@(������@h�������@h�������@h�������@h�������@h���������������������������(��� �	 	
h�
�h���h��h��h���������h���h���h���h���h��	h���h�B�����	���
�����������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:20:06Z</structure-indexed-at>
</compound>
