![N'-[1-[3,5-Bis(trifluoromethyl)phenyl]-3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]-N,N-dimethylimidoformamide](/api/spectrum/4tv41aBOxpc/structure.png?h=300&w=458 "N'-[1-[3,5-Bis(trifluoromethyl)phenyl]-3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]-N,N-dimethylimidoformamide")
| SpectraBase Compound ID | 4nHsvKDWiWR |
|---|---|
| InChI | InChI=1S/C14H13F6N5S/c1-24(2)7-21-11-22-12(26-3)23-25(11)10-5-8(13(15,16)17)4-9(6-10)14(18,19)20/h4-7H,1-3H3/b21-7+ |
| InChIKey | JWLVGASJKITCHF-QPSGOUHRSA-N |
| Mol Weight | 397.34 g/mol |
| Molecular Formula | C14H13F6N5S |
| Exact Mass | 397.079586 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4tv41aBOxpc |
|---|---|
| Name | N'-[1-[3,5-Bis(trifluoromethyl)phenyl]-3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]-N,N-dimethylimidoformamide |
| CAS Registry Number | 252914-91-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H13F6N5S |
| InChI | InChI=1S/C14H13F6N5S/c1-24(2)7-21-11-22-12(26-3)23-25(11)10-5-8(13(15,16)17)4-9(6-10)14(18,19)20/h4-7H,1-3H3/b21-7+ |
| InChIKey | JWLVGASJKITCHF-QPSGOUHRSA-N |
| Molecular Weight | 397.343 g/mol |
| SMILES | c1(nc(SC)n[n]1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1)\N=C\N(C)C |
| SPLASH | splash10-0005-8779000000-5a1134b1a32364720dfb |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 1,2,4-1H-Triazole, 1-[3,5-bis(trifluoromethyl)phenyl]-5-dimethylaminomethylenamino-3-methylthio- N'-[2-[3,5-bis(trifluoromethyl)phenyl]-5-(methylthio)-1,2,4-triazol-3-yl]-N,N-dimethyl-formamidine N'-[2-[3,5-bis(trifluoromethyl)phenyl]-5-(methylthio)-1,2,4-triazol-3-yl]-N,N-dimethylmethanimidamide N'-[2-[3,5-bis(trifluoromethyl)phenyl]-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-formamidine N'-[2-[3,5-bis(trifluoromethyl)phenyl]-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-methanimidamide |
| Wiley ID | 1427354 |