N1-[[(5-Acetyl-2-methoxybenzyl)thio](2,3-dichloroanilino)methylidene]benzene-1-sulfonamide (CHEM060793)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-03 03:22:02 UTC | ||||||||
| Update Date | 2026-04-03 03:22:02 UTC | ||||||||
| Accession Number | CHEM060793 | ||||||||
| Identification | |||||||||
| Common Name | N1-[[(5-Acetyl-2-methoxybenzyl)thio](2,3-dichloroanilino)methylidene]benzene-1-sulfonamide | ||||||||
| Class | Small Molecule | ||||||||
| Description | N1-[[(5-Acetyl-2-methoxybenzyl)thio](2,3-dichloroanilino)methylidene]benzene-1-sulfonamide is a chemical compound with the formula C23H20Cl2N2O4S2. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C23H20Cl2N2O4S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 522.024 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (5-acetyl-2-methoxyphenyl)methyl N'-(benzenesulfonyl)-N-(2,3-dichlorophenyl)carbamimidothioate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C23H20Cl2N2O4S2/c1-15(28)16-11-12-21(31-2)17(13-16)14-32-23(26-20-10-6-9-19(24)22(20)25)27-33(29,30)18-7-4-3-5-8-18/h3-13H,14H2,1-2H3,(H,26,27) | ||||||||
| InChI Key | VXHOVSGZSOAP-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Description | belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. | ||||||||
| Kingdom | Organic compounds | ||||||||
| Super Class | Organic oxygen compounds | ||||||||
| Class | Organooxygen compounds | ||||||||
| Sub Class | Carbonyl compounds | ||||||||
| Direct Parent | Alkyl-phenylketones | ||||||||
| Alternative Parents |
| ||||||||
| Substituents |
| ||||||||
| Molecular Framework | Aromatic homomonocyclic compounds | ||||||||
| External Descriptors | Not Available | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra | Not Available | ||||||||
| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| DrugBank ID | Not Available | ||||||||
| HMDB ID | Not Available | ||||||||
| FooDB ID | Not Available | ||||||||
| Phenol Explorer ID | Not Available | ||||||||
| KNApSAcK ID | Not Available | ||||||||
| BiGG ID | Not Available | ||||||||
| BioCyc ID | Not Available | ||||||||
| METLIN ID | Not Available | ||||||||
| PDB ID | Not Available | ||||||||
| Wikipedia Link | Not Available | ||||||||
| Chemspider ID | Not Available | ||||||||
| ChEBI ID | Not Available | ||||||||
| PubChem Compound ID | 331167 | ||||||||
| Kegg Compound ID | Not Available | ||||||||
| YMDB ID | Not Available | ||||||||
| ECMDB ID | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
