| SpectraBase Spectrum ID |
4OmuXjJM3JB |
| Name |
Pyridine-3-carboxylic acid, 1,2,3,4-tetrahydro-5-cyano-4-(2-ethoxyphenyl)-6-mercapto-2-oxo-, methyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16N2O4S |
| InChI |
InChI=1S/C16H16N2O4S/c1-3-22-11-7-5-4-6-9(11)12-10(8-17)15(23)18-14(19)13(12)16(20)21-2/h4-7,12-13,23H,3H2,1-2H3,(H,18,19) |
| InChIKey |
XOZPMVQVWPEEBG-UHFFFAOYSA-N |
| Molecular Weight |
332.374 g/mol |
| SMILES |
N1C(C(C(C(=C1S)C#N)c1c(OCC)cccc1)C(=O)OC)=O |
| SPLASH |
splash10-006x-9610000000-795e14c06776d1f48d8b |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
5-cyano-2-keto-6-mercapto-4-o-phenetyl-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester
5-cyano-4-(2-ethoxyphenyl)-6-mercapto-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester
Methyl 5-cyano-4-(2-ethoxyphenyl)-2-oxidanylidene-6-sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate
Methyl 5-cyano-4-(2-ethoxyphenyl)-2-oxo-6-sulfanyl-1,2,3,4-tetrahydro-3-pyridinecarboxylate
Methyl 5-cyano-4-(2-ethoxyphenyl)-2-oxo-6-sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate |
| Wiley ID |
1429541 |
