90301 <common-name>Benzimidazo[1,2-c]quinazoline-6(5H)-thione</common-name> <description>Benzimidazo[1,2-c]quinazoline-6(5H)-thione belongs to the benzodiazines, a subclass of diazanaphthalenes within the organic compounds. It is an organoheterocyclic compound with the chemical formula C14H9N3S and an average molecular weight of 251.31 g/mol.</description> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C14H9N3S</chemical-formula> <weight nil="true"/> <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">2026-04-05T00:13:41Z</created-at> <updated-at type="dateTime">2026-04-05T00:13:41Z</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>S=C1N=C2C=CC=CC2=C2NC3=CC=CC=C3N12</moldb-smiles> <moldb-formula>C14H9N3S</moldb-formula> <moldb-inchi>InChI=1/C14H9N3S/c18-14-16-10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)17(13)14/h1-8H,(H,16,18)</moldb-inchi> <moldb-inchikey>VHPHESYILJQPFV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">251.31</moldb-average-mass> <moldb-mono-mass type="decimal">251.0517183</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM086194</chemdb-id> <dsstox-id>DTXSID30947010</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00051366</susdat-id> <iupac nil="true"/> <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>Diazanaphthalenes</klass> <subklass>Benzodiazines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0160980</sync-id> <structure-inchikey>YZELHXRPSMWNIQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000040000100000000000000000000000000000000000000000060000000000000000000002004000000000000000000000000000000000000800800200000000000000000008000000000000000000000000000000000000000000000080000000800000000000000000100000000000000000000000000000000000000804000200000000000000000000100000000000000000000040000000000000000040000084000000000000000000000000000000000000000000000040010000000000000000000000010100000040000004200000001000000000000000001000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���(������@(������@(������@(������@h�������@h�������@h�������@h�������@(������@(������@8�������@(������@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">2026-09-19T04:33:08Z</structure-indexed-at> </compound>