94509 <common-name>5-[(3-Methylthiazolidin-2-ylidene)ethylidene]-4-oxo-2-thioxothiazolidin-3-acetic acid</common-name> <description>5-[(3-Methylthiazolidin-2-ylidene)ethylidene]-4-oxo-2-thioxothiazolidin-3-acetic acid belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This organic acid and derivative has the formula C11H12N2O3S3 and an average molecular weight of 316.41 g/mol.</description> <cas>65152-09-2</cas> <pubchem-id>103296</pubchem-id> <chemical-formula>C11H12N2O3S3</chemical-formula> <weight>316.4</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">2026-04-05T02:47:35Z</created-at> <updated-at type="dateTime">2026-08-18T09:01:10Z</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>CN1CCSC1=CC=C1SC(=S)N(CC(O)=O)C1=O</moldb-smiles> <moldb-formula>C11H12N2O3S3</moldb-formula> <moldb-inchi>InChI=1/C11H12N2O3S3/c1-12-4-5-18-8(12)3-2-7-10(16)13(6-9(14)15)11(17)19-7/h2-3H,4-6H2,1H3,(H,14,15)</moldb-inchi> <moldb-inchikey>AMSAICQWZZDCEM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">316.41</moldb-average-mass> <moldb-mono-mass type="decimal">316.0010052</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2</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>CHEM090402</chemdb-id> <dsstox-id>DTXSID60886746</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00056315</susdat-id> <iupac>2-[5-[2-(3-methyl-1,3-thiazolidin-2-ylidene)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic 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>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">0</paper-count> <sync-id>CED0092691</sync-id> <structure-inchikey>AMSAICQWZZDCEM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800040000000000000040000000000000100000000000000400000001020000000000000000004000000000000000002000000000000000000000000000000080000000000000020000010000200000000000000000000000400010000000000000000010020000000020100100000000000000000000000000040000000000000000000404000000000000000000000000000000000000000008000000000000000080000040000000020000080008000000000000000000000000000000100000000000000800000040080040000400000000000000000000000000000000000000000800400000208010000000000000000000008</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������(�������`�������`������� ������(�������h��������h��������(������� ������(�������(�������(�������`�������(�������h��������(�������(�������(�����������������������(��� ��(�� � � �(� � � � ���� ��(��� ��(��� �� B����������� ��� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:35:49Z</structure-indexed-at> </compound>