362178 <common-name>9-chloro-3-methylsulfanyl-5,7-dithia-4,10,11,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene</common-name> <description>9-chloro-3-methylsulfanyl-5,7-dithia-4,10,11,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene is a chemical compound with the formula C7H3ClN4S3. It has an average molecular weight of 274.80 g/mol.</description> <cas nil="true"/> <pubchem-id>3077775</pubchem-id> <chemical-formula>C7H3ClN4S3</chemical-formula> <weight>274.8</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">2026-09-01T11:17:46Z</created-at> <updated-at type="dateTime">2026-09-01T11:17:46Z</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>CSC1=NSC2=C1C3=C(S2)C(=NN=N3)Cl</moldb-smiles> <moldb-formula>C7H3ClN4S3</moldb-formula> <moldb-inchi>InChI=1S/C7H3ClN4S3/c1-13-6-2-3-4(5(8)10-12-9-3)14-7(2)15-11-6/h1H3</moldb-inchi> <moldb-inchikey>LIJPIIZMXUSVQH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">273.9208373</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM358071</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>9-chloro-3-methylsulfanyl-5,7-dithia-4,10,11,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene</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>Organoheterocyclic compounds</superklass> <klass>Thienothiazoles</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0312268</sync-id> <structure-inchikey>LIJPIIZMXUSVQH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000000820100000012000002000000000400000000004000000000000000010000000002000200000000000000000000000000000200000000000400004000001000000000000000010000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000040000000000000000000000000080000000000000002000000000000000000000000000000000000080000000000000000000000000000400000004000000000000008000000000000000000000010000000001800000000000000000000000000001000018000000000000800000000000000008000000000000002</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�B����������� ����� �� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:59:18Z</structure-indexed-at> </compound>