4,5-Bis(benzoylthio)-1,2-dithiole-3-thione
S-(3-benzoylsulfanyl-5-sulfanylidenedithiol-4-yl) benzenecarbothioate
Also Known As: 4,5-Bis(benzoylthio)-1,2-dithiole-3-thione|S-(3-benzoylsulfanyl-5-sulfanylidenedithiol-4-yl) benzenecarbothioate|4,5-BIS(BENZOYLTHIO)-1,2-DITHIOL-3-THIONE|4,5-bis-(Benzoylthio)-1,2-dithiol-3-thione|3,4-Bis(benzoylthio)-5H-1,2-dithiole-5-thione|phenyl 5-(phenylcarbonylthio)-3-thioxo(1,2-dithiolen-4-ylthio) ketone|S,S'-(3-Sulfanylidene-3H-1,2-dithiole-4,5-diyl) dibenzenecarbothioate|{[5-(benzoylsulfanyl)-3-sulfanylidene-3H-1,2-dithiol-4-yl]sulfanyl}(phenyl)methanone|Benzenecarbothioicacid, S,S'-(3-thioxo-3H-1,2-dithiole-4,5-diyl) ester (9CI)|S-[5-(Benzoylsulfanyl)-3-thioxo-3H-1,2-dithiol-4-yl] benzenecarbothioate #
| Molecular Formula | C17H10O2S5 |
|---|---|
| Molecular Weight | 405.92844 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.92844 |
| Monoisotopic Mass | 405.92844 |
| Heavy Atoms | 24 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 82504-65-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)SC2=C(SSC2=S)SC(=O)C3=CC=CC=C3 |
| InChIKey | ACVFKHLFCLEUPR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Bis(benzoylthio)-1,2-dithiole-3-thione (CAS 82504-65-2), with molecular formula C17H10O2S5 and molecular weight 405.92844 g/mol. IUPAC: S-(3-benzoylsulfanyl-5-sulfanylidenedithiol-4-yl) benzenecarbothioate.