4-[(e)-(4-bromophenyl)methylideneamino]-3-(3-ethoxyphenyl)-1h-1,2,4-triazole-5-thione (CHEM301618)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-28 23:20:33 UTC | ||||||||
| Update Date | 2026-08-28 23:20:33 UTC | ||||||||
| Accession Number | CHEM301618 | ||||||||
| Identification | |||||||||
| Common Name | 4-[(e)-(4-bromophenyl)methylideneamino]-3-(3-ethoxyphenyl)-1h-1,2,4-triazole-5-thione | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4-[(e)-(4-bromophenyl)methylideneamino]-3-(3-ethoxyphenyl)-1h-1,2,4-triazole-5-thione belongs to the triazoles, a subclass of azoles within the organic compounds. It is classified as an organoheterocyclic compound with the formula C17H15BrN4OS. The compound has an average molecular weight of 403.30 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H15BrN4OS | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 402.015 g/mol | ||||||||
| CAS Registry Number | 613249-70-0 | ||||||||
| IUPAC Name | 4-[(e)-(4-bromophenyl)methylideneamino]-3-(3-ethoxyphenyl)-1h-1,2,4-triazole-5-thione | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCOC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)Br | ||||||||
| InChI Identifier | InChI=1S/C17H15BrN4OS/c1-2-23-15-5-3-4-13(10-15)16-20-21-17(24)22(16)19-11-12-6-8-14(18)9-7-12/h3-11H,2H2,1H3,(H,21,24)/b19-11+ | ||||||||
| InChI Key | ORQOTHVAVFBHOA-YBFXNURJSA-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 | ||||||||
