![2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-thienyl)ethanone](/api/spectrum/AtNJsqxmwPi/structure.png?h=300&w=458 "2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-thienyl)ethanone")
| SpectraBase Compound ID | 8DoX17kH8Fb |
|---|---|
| InChI | InChI=1S/C20H15N3OS2/c24-17(18-12-7-13-25-18)14-26-20-22-21-19(15-8-3-1-4-9-15)23(20)16-10-5-2-6-11-16/h1-13H,14H2 |
| InChIKey | CWJBIHJQGQSJGO-UHFFFAOYSA-N |
| Mol Weight | 377.48 g/mol |
| Molecular Formula | C20H15N3OS2 |
| Exact Mass | 377.065654 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AtNJsqxmwPi |
|---|---|
| Name | 2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-thienyl)ethanone |
| CAS Registry Number | 309742-66-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H15N3OS2 |
| InChI | InChI=1S/C20H15N3OS2/c24-17(18-12-7-13-25-18)14-26-20-22-21-19(15-8-3-1-4-9-15)23(20)16-10-5-2-6-11-16/h1-13H,14H2 |
| InChIKey | CWJBIHJQGQSJGO-UHFFFAOYSA-N |
| Molecular Weight | 377.480 g/mol |
| SMILES | c1ccc(-[n]2c(nnc2SCC(c2sccc2)=O)-c2ccccc2)cc1 |
| SPLASH | splash10-03di-7910000000-98bc8a55dce84fccf7b5 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-thienyl)ethanone 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-yl-ethanone 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-(2-thienyl)ethanone 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-thiophen-2-ylethanone Ethanone, 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]-1-(2-thienyl)- |
| Wiley ID | 1432746 |