| SpectraBase Spectrum ID |
B2XsJjUD6oq |
| Name |
Pyridine-3-carboxylic acid, 1,4-dihydro-4-(4-chlorophenyl)-5-cyano-6-mercapto-2-methyl-, tert-butyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19ClN2O2S |
| InChI |
InChI=1S/C18H19ClN2O2S/c1-10-14(17(22)23-18(2,3)4)15(13(9-20)16(24)21-10)11-5-7-12(19)8-6-11/h5-8,15,21,24H,1-4H3 |
| InChIKey |
IWUVSBBKWACNBA-UHFFFAOYSA-N |
| Molecular Weight |
362.875 g/mol |
| SMILES |
N1C(=C(C(C(=C1S)C#N)c1ccc(cc1)Cl)C(OC(C)(C)C)=O)C |
| SPLASH |
splash10-0a4l-9340000000-9c342a8e65b544ad6dc5 |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
4-(4-Chlorophenyl)-5-cyano-6-mercapto-2-methyl-1,4-dihydropyridine-3-carboxylic acid tert-butyl ester
tert-Butyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-1,4-dihydro-3-pyridinecarboxylate
tert-Butyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate |
| Wiley ID |
1431138 |
