334275 <common-name>8-chloro-5-methylsulfanyl-1,6-diphenyl-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine</common-name> <description>8-chloro-5-methylsulfanyl-1,6-diphenyl-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine is a chemical compound with the formula C23H17ClN4S. It has an average molecular weight of 416.90 g/mol.</description> <cas>153901-46-3</cas> <pubchem-id>3073956</pubchem-id> <chemical-formula>C23H17ClN4S</chemical-formula> <weight>416.9</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">2026-08-30T15:53:44Z</created-at> <updated-at type="dateTime">2026-08-30T15:53:44Z</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=CC2=NN=C(N2C3=C(N1C4=CC=CC=C4)C=C(C=C3)Cl)C5=CC=CC=C5</moldb-smiles> <moldb-formula>C23H17ClN4S</moldb-formula> <moldb-inchi>InChI=1S/C23H17ClN4S/c1-29-22-15-21-25-26-23(16-8-4-2-5-9-16)28(21)19-13-12-17(24)14-20(19)27(22)18-10-6-3-7-11-18/h2-15H,1H3</moldb-inchi> <moldb-inchikey>YFTISWPTCLMZJD-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">416.0862454</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.8</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>CHEM330168</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>8-chloro-5-methylsulfanyl-1,6-diphenyl-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine</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>Azoles</klass> <subklass>Triazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284753</sync-id> <structure-inchikey>YFTISWPTCLMZJD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000002000000080000000800000000002440000000000080000000000000000000000000000000000000002004200000000000000000000000200000000000040000400000000000000000000000000000000000000000008000000000000000000080000000000000100000000000800120000008000000000000000000004040000000800000000000200000880080010100002000000040000000000100000000000000000000080000000000000000000000000000000800000000000000000000000000040000000000000012000000003000000200000000000000000040000000000040000000001000000000000000000040000000000000</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���h� �h���h���h���h������ ��h���h���h���h���h��� ��h�� h���h���h�B��������� �������� ���������� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:36:09Z</structure-indexed-at> </compound>