3-(1h-imidazol-5-yl)propyl n'-[(4-chlorophenyl)methyl]carbamimidothioate (CHEM179275)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-19 06:09:08 UTC | ||||||||
| Update Date | 2026-08-19 06:09:08 UTC | ||||||||
| Accession Number | CHEM179275 | ||||||||
| Identification | |||||||||
| Common Name | 3-(1h-imidazol-5-yl)propyl n'-[(4-chlorophenyl)methyl]carbamimidothioate | ||||||||
| Class | Small Molecule | ||||||||
| Description | 3-(1h-imidazol-5-yl)propyl n'-[(4-chlorophenyl)methyl]carbamimidothioate is an organic compound with the formula C14H17ClN4S and an average molecular weight of 308.80 g/mol. 3-(1h-imidazol-5-yl)propyl n'-[(4-chlorophenyl)methyl]carbamimidothioate belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. It is identified as being found in or released from two recorded sources: cigar cigarettes, which fall under household cleaning and consumer products, and electrically stimulated smoking devices, which are categorized as electrical and electronic equipment. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C14H17ClN4S | ||||||||
| Average Molecular Mass | 308.800 g/mol | ||||||||
| Monoisotopic Mass | 308.086 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 3-(1H-imidazol-5-yl)propyl N'-[(4-chlorophenyl)methyl]carbamimidothioate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C14H17ClN4S/c15-12-5-3-11(4-6-12)8-18-14(16)20-7-1-2-13-9-17-10-19-13/h3-6,9-10H,1-2,7-8H2,(H2,16,18)(H,17,19) | ||||||||
| InChI Key | UCAIEVHKDLMIFL-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 |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
| ||||||||
| 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 | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
