69049 <common-name>6-(2-Diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno(2,3-b)pyridin-5-one</common-name> <description>6-(2-Diethylaminoethylamino)-2,4,9-(trimethyl)thiochromeno(2,3-b)pyridin-5-one belongs to the 1-benzopyrans, a subclass of benzopyrans within the organic compounds. This organoheterocyclic compound has the formula C21H27N3O1S1 and an average molecular weight of 369.53 g/mol.</description> <cas>13988-28-8</cas> <pubchem-id>84136</pubchem-id> <chemical-formula>C21H27N3O1S1</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">2026-04-03T14:27:41Z</created-at> <updated-at type="dateTime">2026-04-03T14:27:41Z</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>CCN(CC)CCNC1=C2C(=O)C3=C(SC2=C(C)C=C1)N=C(C)C=C3C</moldb-smiles> <moldb-formula>C21H27N3O1S1</moldb-formula> <moldb-inchi>InChI=1S/C21H27N3OS/c1-6-24(7-2)11-10-22-16-9-8-13(3)20-18(16)19(25)17-14(4)12-15(5)23-21(17)26-20/h8-9,12,22H,6-7,10-11H2,1-5H3</moldb-inchi> <moldb-inchikey>CYJKCTSECWDKKL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">369.53</moldb-average-mass> <moldb-mono-mass type="decimal">369.187483</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>75906</chemspider-id> <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>CHEM064942</chemdb-id> <dsstox-id>DTXSID20161182</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00024525</susdat-id> <iupac>6-[2-(diethylamino)ethylamino]-2,4,9-trimethylthiochromeno[2,3-b]pyridin-5-one</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>Benzopyrans</klass> <subklass>1-benzopyrans</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0158936</sync-id> <structure-inchikey>CYJKCTSECWDKKL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000100000002000000000000040000000100000000002000020000000000080002000000000000000000000000000000001000400800000000000000000000800000020001010000000300000000000000000000000000000000000010000104000100000000800000200000000000000000000000040000000000000000000000080000000000000000080000000000000000000000000000000000000080100000080020000000000000000000000800000000000000000000020000000000000008000100020002010000200000000000000000000000001800040000000000000000001000000048000000000000800</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">2026-09-19T04:18:55Z</structure-indexed-at> </compound>