312840 <common-name>[4-(4-chlorophenyl)-2,3-dimethylbutan-2-yl] n-pyridin-3-ylcarbamodithioate</common-name> <description>[4-(4-chlorophenyl)-2,3-dimethylbutan-2-yl] n-pyridin-3-ylcarbamodithioate is a chemical compound with the formula C18H21ClN2S2. It has an average molecular weight of 365.00 g/mol.</description> <cas>34763-25-2</cas> <pubchem-id>3038356</pubchem-id> <chemical-formula>C18H21ClN2S2</chemical-formula> <weight>365</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">2026-08-29T09:33:02Z</created-at> <updated-at type="dateTime">2026-08-29T09:33:02Z</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>CC(CC1=CC=C(C=C1)Cl)C(C)(C)SC(=S)NC2=CN=CC=C2</moldb-smiles> <moldb-formula>C18H21ClN2S2</moldb-formula> <moldb-inchi>InChI=1S/C18H21ClN2S2/c1-13(11-14-6-8-15(19)9-7-14)18(2,3)23-17(22)21-16-5-4-10-20-12-16/h4-10,12-13H,11H2,1-3H3,(H,21,22)</moldb-inchi> <moldb-inchikey>FLJRPGCXUOOPDK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">364.0834687</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.6</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>CHEM308733</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>[4-(4-chlorophenyl)-2,3-dimethylbutan-2-yl] n-pyridin-3-ylcarbamodithioate</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>CED0263763</sync-id> <structure-inchikey>FLJRPGCXUOOPDK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000009800040022800040000000000000100000080000000000000001000000200000000000000002000800000000004000000000000000000000000000000400000000000000000000000000000000001000000000000000000000000010080000000004000000000000000000000000000000000000000000000100040820000800000000000000080004000000000000000000000000000000000000000000010000000080000000000004000000000000000000000000100000000420020001000000000000000000010000000000000000220000000000000008000000040002040080040000000000000040000000000000000000000</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���h�B����������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:19:43Z</structure-indexed-at> </compound>