311595 <common-name>(3e)-3-(2-bromothioxanthen-9-ylidene)-n,n-dimethylpropan-1-amine</common-name> <description>(3e)-3-(2-bromothioxanthen-9-ylidene)-n,n-dimethylpropan-1-amine is a chemical compound with the formula C18H18BrNS. It has an average molecular weight of 360.30 g/mol.</description> <cas nil="true"/> <pubchem-id>6437351</pubchem-id> <chemical-formula>C18H18BrNS</chemical-formula> <weight>360.3</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">2026-08-29T07:53:26Z</created-at> <updated-at type="dateTime">2026-08-29T07:53:26Z</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>CN(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Br</moldb-smiles> <moldb-formula>C18H18BrNS</moldb-formula> <moldb-inchi>InChI=1S/C18H18BrNS/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18/h3-4,6-10,12H,5,11H2,1-2H3/b14-7+</moldb-inchi> <moldb-inchikey>IXPKCMNCHLYROC-VGOFMYFVSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">359.03433</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.2</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>CHEM307488</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>(3e)-3-(2-bromothioxanthen-9-ylidene)-n,n-dimethylpropan-1-amine</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>Benzothiopyrans</klass> <subklass>1-benzothiopyrans</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0262546</sync-id> <structure-inchikey>IXPKCMNCHLYROC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000200000000000000000000000000000000000000000080000000000000008000000000044000000000000000000000000000000000000000000000000000000000000008000010000600000000800080000220000080000000000000000000104000000400000000040000000080000400000000000040000000800000008000000004100000000500000000000000000000000000004000000000000001080000000000000000000000000000000000000000000000000040000000000100000000000000000000000000000200008000000000000000000000000040000000000000000001000000000000000000000008</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�B�������� ���� ��������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:18:44Z</structure-indexed-at> </compound>