316090 <common-name>2-[[(5e)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid</common-name> <description>2-[[(5e)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid is a chemical compound with the formula C19H16N2O5S2. It has an average molecular weight of 416.50 g/mol.</description> <cas>89752-53-4</cas> <pubchem-id>129626313</pubchem-id> <chemical-formula>C19H16N2O5S2</chemical-formula> <weight>416.5</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">2026-08-29T13:43:05Z</created-at> <updated-at type="dateTime">2026-08-29T13:43:05Z</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>COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CNC3=CC=CC=C3C(=O)O)O</moldb-smiles> <moldb-formula>C19H16N2O5S2</moldb-formula> <moldb-inchi>InChI=1S/C19H16N2O5S2/c1-26-15-8-11(6-7-14(15)22)9-16-17(23)21(19(27)28-16)10-20-13-5-3-2-4-12(13)18(24)25/h2-9,20,22H,10H2,1H3,(H,24,25)/b16-9+</moldb-inchi> <moldb-inchikey>ZABNWJMQJGWNOX-CXUHLZMHSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">416.050064</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.4</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>CHEM311983</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-[[(5e)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid</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>CED0266931</sync-id> <structure-inchikey>ZABNWJMQJGWNOX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000008000400000000000000000000000000001000000004000004040800000200000000000000000040000000000000000800000000000000000000000000000000800000200000000200000100003000000000000000000000000000100000000400021001100000000000001001000000000000000000010000100400000008000000000000000800080000001000000c00000000000000000000000000000000000000a0000000080000021000000100000000400000080000000000000002100000000400000000000008000040000000200000000000000000008000000000040000000a00400000000000020000100000000004008</structure-fingerprint> <structure-pattern-fingerprint>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</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�� ���h�B������������ � ������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:22:13Z</structure-indexed-at> </compound>