365099 <common-name>8-(2-aminoethylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7h-purin-2-one</common-name> <description>8-(2-aminoethylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7h-purin-2-one is a compound with the formula C9H13N5OS2. It has an average molecular weight of 271.40 g/mol.</description> <cas>6559-88-2</cas> <pubchem-id>3034555</pubchem-id> <chemical-formula>C9H13N5OS2</chemical-formula> <weight>271.4</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">2026-09-01T15:32:28Z</created-at> <updated-at type="dateTime">2026-09-01T15:32:28Z</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>CN1C2=C(C(=S)N(C1=O)C)NC(=N2)SCCN</moldb-smiles> <moldb-formula>C9H13N5OS2</moldb-formula> <moldb-inchi>InChI=1S/C9H13N5OS2/c1-13-6-5(7(16)14(2)9(13)15)11-8(12-6)17-4-3-10/h3-4,10H2,1-2H3,(H,11,12)</moldb-inchi> <moldb-inchikey>OHAMGOXGOKLILR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">271.0561524</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.1</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>CHEM360992</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-(2-aminoethylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7h-purin-2-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>Imidazopyrimidines</klass> <subklass>Purines and purine derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0315058</sync-id> <structure-inchikey>OHAMGOXGOKLILR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2010000800040000800000000000000000000000000000000000000000000000020000004000000002000008000000000000000000000000000000000040000080000000000000000000020000200000000000000000000008010000000000000000000000000100000000000000100000000000400000000008000020040000000000000200000004000001002000000000000000000000000000000020000000000000400080000000000000000000000000000000000002000000000000000000000000000000000000000008000040200004000000000000000000000008001000000000000000000000000000000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������@(������@(�������(������@(������@(�������(�������`������@8�������@(������@(������� ������`�������`�������`�����������h���h���h���(���h���h���(�� �� h� �h���h�� � ����������h���h�B������������ ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:17Z</structure-indexed-at> </compound>