| SpectraBase Spectrum ID |
8phVaqeSaFP |
| Name |
3-Amino-5-(benzylsulfanyl)-6-chloro-2-pyrazinecarboxylic acid |
| Alternate Name(s) |
3-Amino-5-(benzylthio)-6-chloro-pyrazinoic acid
3-Amino-5-(benzylthio)-6-chloropyrazine-2-carboxylic acid
3-Amino-5-benzylsulfanyl-6-chloro-pyrazine-2-carboxylic acid
3-Amino-6-chloro-5-(phenylmethylthio)-2-pyrazinecarboxylic acid
3-Azanyl-6-chloranyl-5-(phenylmethylsulfanyl)pyrazine-2-carboxylic acid |
| CAS Registry Number |
284674-33-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H10ClN3O2S |
| InChI |
InChI=1S/C12H10ClN3O2S/c13-9-11(16-10(14)8(15-9)12(17)18)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,14,16)(H,17,18) |
| InChIKey |
KJGHIMXKAOBMKM-UHFFFAOYSA-N |
| Molecular Weight |
295.744 g/mol |
| SMILES |
Nc1nc(c(nc1C(=O)O)Cl)SCc1ccccc1 |
| SPLASH |
splash10-0006-9130000000-1179eaa912b33142d0ed |
| Source of Spectrum |
AD-0-2532-0 |
| Wiley ID |
1433181 |
