337245 <common-name>1-[(4-tert-butylphenyl)methylsulfanyl]-1-(3-methylpentan-3-ylsulfanyl)-n-pyridin-3-ylmethanimine</common-name> <description>1-[(4-tert-butylphenyl)methylsulfanyl]-1-(3-methylpentan-3-ylsulfanyl)-n-pyridin-3-ylmethanimine is a chemical compound with the formula C23H32N2S2. It has an average molecular weight of 400.60 g/mol.</description> <cas>51308-59-9</cas> <pubchem-id>3039815</pubchem-id> <chemical-formula>C23H32N2S2</chemical-formula> <weight>400.6</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">2026-08-30T20:01:33Z</created-at> <updated-at type="dateTime">2026-08-30T20:01:33Z</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>CCC(C)(CC)SC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C</moldb-smiles> <moldb-formula>C23H32N2S2</moldb-formula> <moldb-inchi>InChI=1S/C23H32N2S2/c1-7-23(6,8-2)27-21(25-20-10-9-15-24-16-20)26-17-18-11-13-19(14-12-18)22(3,4)5/h9-16H,7-8,17H2,1-6H3</moldb-inchi> <moldb-inchikey>IKQLWDOBBHJGCZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">400.2006914</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>7.8</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>CHEM333138</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>1-[(4-tert-butylphenyl)methylsulfanyl]-1-(3-methylpentan-3-ylsulfanyl)-n-pyridin-3-ylmethanimine</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylpropanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0287686</sync-id> <structure-inchikey>IKQLWDOBBHJGCZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400001000000840000002800000000000000000000000000000000000000000003000200000000000000002000800400000004000000000000000000000000000000000001000000000100000000000000000000000004000000002000000000010000000000000000000000000000000000080000000000000000000000100040000002800000000000000000008000000000000000000000000000000000000000001080020000080000000040000000000000000000000000000100400800000020001004000000000000440000000000000000001220000000000000000000004002002040000000000000000000040000000000000000000000</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">2026-09-19T05:38:25Z</structure-indexed-at> </compound>