2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-n-(3,4-difluorophenyl)acetamide (CHEM301100)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-28 22:45:28 UTC | ||||||||
| Update Date | 2026-08-28 22:45:28 UTC | ||||||||
| Accession Number | CHEM301100 | ||||||||
| Identification | |||||||||
| Common Name | 2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-n-(3,4-difluorophenyl)acetamide | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-n-(3,4-difluorophenyl)acetamide belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the benzenoids superclass. This compound has the formula C17H13F2N3OS3 and an average molecular weight of 409.50 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H13F2N3OS3 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 409.019 g/mol | ||||||||
| CAS Registry Number | 477330-80-6 | ||||||||
| IUPAC Name | 2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-n-(3,4-difluorophenyl)acetamide | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | C1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)NC3=CC(=C(C=C3)F)F | ||||||||
| InChI Identifier | InChI=1S/C17H13F2N3OS3/c18-13-7-6-12(8-14(13)19)20-15(23)10-25-17-22-21-16(26-17)24-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,20,23) | ||||||||
| InChI Key | NGXZIACKSLPAJG-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| 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 |
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| Predicted Properties | Not Available | ||||||||
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| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
