![3-tert-Butyl-7-[(4-chlorobenzyl)sulfanyl]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one](/api/spectrum/AGcUxu3Rvd4/structure.png?h=300&w=458 "3-tert-Butyl-7-[(4-chlorobenzyl)sulfanyl]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one")
| SpectraBase Compound ID | 35cNeKUyMKM |
|---|---|
| InChI | InChI=1S/C15H15ClN4OS2/c1-15(2,3)11-12(21)20-13(18-17-11)23-14(19-20)22-8-9-4-6-10(16)7-5-9/h4-7H,8H2,1-3H3 |
| InChIKey | VSQIIRRUZXDQOD-UHFFFAOYSA-N |
| Mol Weight | 366.89 g/mol |
| Molecular Formula | C15H15ClN4OS2 |
| Exact Mass | 366.037581 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AGcUxu3Rvd4 |
|---|---|
| Name | 3-tert-Butyl-7-[(4-chlorobenzyl)sulfanyl]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Alternate Name(s) | 3-tert-Butyl-7-[(4-chlorobenzyl)thio]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one 3-tert-Butyl-7-[(4-chlorophenyl)methylsulfanyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one 3-tert-Butyl-7-[(4-chlorophenyl)methylthio]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one [1,3,4]Thiadiazolo[2,3-c][1,2,4]triazin-4-one, 3-tert-butyl-7-(4-chlorobenzylsulfanyl)- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H15ClN4OS2 |
| InChI | InChI=1S/C15H15ClN4OS2/c1-15(2,3)11-12(21)20-13(18-17-11)23-14(19-20)22-8-9-4-6-10(16)7-5-9/h4-7H,8H2,1-3H3 |
| InChIKey | VSQIIRRUZXDQOD-UHFFFAOYSA-N |
| Molecular Weight | 366.885 g/mol |
| SMILES | CC(C=1C(N2C(SC(=N2)SCc2ccc(Cl)cc2)=NN1)=O)(C)C |
| SPLASH | splash10-004i-7900000000-4b98c94e90d71da426ed |
| Wiley ID | 1447741 |