[2-[(e)-[(3-chlorophenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-chlorobenzoate (CHEM321251)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 03:04:19 UTC | ||||||||
| Update Date | 2026-08-30 03:04:19 UTC | ||||||||
| Accession Number | CHEM321251 | ||||||||
| Identification | |||||||||
| Common Name | [2-[(e)-[(3-chlorophenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-chlorobenzoate | ||||||||
| Class | Small Molecule | ||||||||
| Description | [2-[(e)-[(3-chlorophenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-chlorobenzoate is a chemical compound with the formula C21H15Cl2N3O2S. It has an average molecular weight of 444.30 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C21H15Cl2N3O2S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 443.026 g/mol | ||||||||
| CAS Registry Number | 769152-13-8 | ||||||||
| IUPAC Name | [2-[(e)-[(3-chlorophenyl)carbamothioylhydrazinylidene]methyl]phenyl] 4-chlorobenzoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | C1=CC=C(C(=C1)C=NNC(=S)NC2=CC(=CC=C2)Cl)OC(=O)C3=CC=C(C=C3)Cl | ||||||||
| InChI Identifier | InChI=1S/C21H15Cl2N3O2S/c22-16-10-8-14(9-11-16)20(27)28-19-7-2-1-4-15(19)13-24-26-21(29)25-18-6-3-5-17(23)12-18/h1-13H,(H2,25,26,29)/b24-13+ | ||||||||
| InChI Key | BYIUXRHCOXWJGU-ZMOGYAJESA-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 | ||||||||
