![1-[(3-chlorobenzyl)thio]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole](/api/spectrum/3VmgBWyTlgd/structure.png?h=300&w=458 "1-[(3-chlorobenzyl)thio]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole")
| SpectraBase Compound ID | 3ZECjFWmqy |
|---|---|
| InChI | InChI=1S/C15H10ClN3S2/c16-11-5-3-4-10(8-11)9-20-14-17-18-15-19(14)12-6-1-2-7-13(12)21-15/h1-8H,9H2 |
| InChIKey | SDDUHCYWAFDZNV-UHFFFAOYSA-N |
| Mol Weight | 331.84 g/mol |
| Molecular Formula | C15H10ClN3S2 |
| Exact Mass | 331.000467 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3VmgBWyTlgd |
|---|---|
| Name | 1-[(3-chlorobenzyl)thio]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
| Alternate Name(s) | 1-[(3-chlorophenyl)methylsulfanyl]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole 1-[(3-chlorophenyl)methylthio]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole 3-[(3-chlorobenzyl)sulfanyl][1,2,4]triazolo[3,4-b][1,3]benzothiazole Benzo[4,5]thiazolo[2,3-c][1,2,4]triazole, 3-(3-chlorobenzylsulfanyl)- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H10ClN3S2 |
| InChI | InChI=1S/C15H10ClN3S2/c16-11-5-3-4-10(8-11)9-20-14-17-18-15-19(14)12-6-1-2-7-13(12)21-15/h1-8H,9H2 |
| InChIKey | SDDUHCYWAFDZNV-UHFFFAOYSA-N |
| Molecular Weight | 331.839 g/mol |
| SMILES | c1ccc2-[n]3c(nnc3SCc3cc(Cl)ccc3)Sc2c1 |
| SPLASH | splash10-004i-9810000000-0514cc86e634c18075e1 |
| Wiley ID | 1441438 |