| SpectraBase Spectrum ID |
F2vYj43rKh4 |
| Name |
1H-Pyrazole-3,4-dicarboxylic acid, 5-(phenylthio)-1-(1-piperidinyl)-, dimethyl ester |
| CAS Registry Number |
79489-86-4 |
| 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)19-21(20-11-7-4-8-12-20)16(14)26-13-9-5-3-6-10-13/h3,5-6,9-10H,4,7-8,11-12H2,1-2H3 |
| InChIKey |
BGJCLLJADAMZJN-UHFFFAOYSA-N |
| Molecular Weight |
375.443 g/mol |
| SMILES |
c1([n](nc(c1C(=O)OC)C(=O)OC)N1CCCCC1)Sc1ccccc1 |
| SPLASH |
splash10-000x-9284000000-7bf711cfc92532f2c0ce |
| Source of Spectrum |
K-114-2462-0 |
| Synonyms |
Dimethyl 5-(phenylsulfanyl)-1-(1-piperidinyl)-1H-pyrazole-3,4-dicarboxylate
Dimethylester of 5-(phenylthio)-1-piperidino-3,4-pyrazoldicarboxylic acid |
| Wiley ID |
1357132 |
