[5-nitro-2-[(4-phenyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)methylamino]phenyl]-phenylmethanone (CHEM204910)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-21 21:04:29 UTC | ||||||||
| Update Date | 2026-08-21 21:04:29 UTC | ||||||||
| Accession Number | CHEM204910 | ||||||||
| Identification | |||||||||
| Common Name | [5-nitro-2-[(4-phenyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)methylamino]phenyl]-phenylmethanone | ||||||||
| Class | Small Molecule | ||||||||
| Description | [5-nitro-2-[(4-phenyl-5-sulfanylidene-1h-1,2,4-triazol-3-yl)methylamino]phenyl]-phenylmethanone belongs to the benzophenones, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C22H17N5O3S and an average molecular weight of 431.50 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C22H17N5O3S | ||||||||
| Average Molecular Mass | 431.500 g/mol | ||||||||
| Monoisotopic Mass | 431.105 g/mol | ||||||||
| CAS Registry Number | 111070-79-2 | ||||||||
| IUPAC Name | [5-nitro-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylamino]phenyl]-phenylmethanone | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C22H17N5O3S/c28-21(15-7-3-1-4-8-15)18-13-17(27(29)30)11-12-19(18)23-14-20-24-25-22(31)26(20)16-9-5-2-6-10-16/h1-13,23H,14H2,(H,25,31) | ||||||||
| InChI Key | MAPDIPUVFZFIHF-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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| 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 | ||||||||
