| SpectraBase Spectrum ID |
CEv5Ar64ey3 |
| Name |
1H-Pyrazole-4,5-dicarboxylic acid, 3-(phenylthio)-1-(1-piperidinyl)-, dimethyl ester |
| CAS Registry Number |
78365-69-2 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21N3O4S |
| InChI |
InChI=1S/C18H21N3O4S/c1-24-17(22)14-15(18(23)25-2)21(20-11-7-4-8-12-20)19-16(14)26-13-9-5-3-6-10-13/h3,5-6,9-10H,4,7-8,11-12H2,1-2H3 |
| InChIKey |
ZBUDRHRWUGMPNQ-UHFFFAOYSA-N |
| Molecular Weight |
375.443 g/mol |
| SMILES |
c1([n](nc(c1C(=O)OC)Sc1ccccc1)N1CCCCC1)C(=O)OC |
| SPLASH |
splash10-00o3-8096000000-a0f3cca2a43bdc2ba6de |
| Source of Spectrum |
K-114-1744-0 |
| Synonyms |
Dimethyl 3-(phenylsulfanyl)-1-(1-piperidinyl)-1H-pyrazole-4,5-dicarboxylate
Dimethylester of 3-phenylthio-1-piperidino-4,5-pyrazoldicarboxylic acid |
| Wiley ID |
1357131 |
