| SpectraBase Spectrum ID |
4llj4kIs8Ve |
| Name |
2-(2-amino-5-benzylsulfanyl-1,3,4-thiadiazol-3-ium-3-yl)-1-phenyl-ethanone |
| CAS Registry Number |
339223-52-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16N3OS2 |
| InChI |
InChI=1S/C17H15N3OS2/c18-16-20(11-15(21)14-9-5-2-6-10-14)19-17(23-16)22-12-13-7-3-1-4-8-13/h1-10,18H,11-12H2/p+1 |
| InChIKey |
XUHOLAPFBCMJDN-UHFFFAOYSA-O |
| Molecular Weight |
342.455 g/mol |
| SMILES |
Nc1[n+](nc(s1)SCc1ccccc1)CC(=O)c1ccccc1 |
| SPLASH |
splash10-0006-9300000000-66f60b36a1798d4c9a7b |
| Synonyms |
2-Amino-3-benzoylmethyl-5-benzylthio-1,3,4-thiadiazole
2-[2-amino-5-(benzylthio)-1,3,4-thiadiazol-3-ium-3-yl]-1-phenyl-ethanone
2-[2-amino-5-(phenylmethylthio)-1,3,4-thiadiazol-3-ium-3-yl]-1-phenylethanone
2-[2-azanyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-3-ium-3-yl]-1-phenyl-ethanone |
| Wiley ID |
1470111 |
