SpectraBase Spectrum ID |
A7IPyyohS06 |
Name |
5-(4-Chlorophenylsulfonylamino)-1-phenyl-N-(1-phenylmethyl-4-piperidinyl)-1H-pyrazole-4-carboxamide dihydrate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H30ClN5O4S |
InChI |
InChI=1S/C28H28ClN5O3S.H2O/c29-22-11-13-25(14-12-22)38(36,37)32-27-26(19-30-34(27)24-9-5-2-6-10-24)28(35)31-23-15-17-33(18-16-23)20-21-7-3-1-4-8-21;/h1-14,19,23,32H,15-18,20H2,(H,31,35);1H2 |
InChIKey |
DVOHEYILAIIGAX-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/ardp.200800181 |
Molecular Weight |
568.092 g/mol |
SMILES |
O.N(C(c1c([n](nc1)-c1ccccc1)NS(=O)(=O)c1ccc(cc1)Cl)=O)C1CCN(CC1)Cc1ccccc1 |
SPLASH |
splash10-006x-9101000000-deb870603588d86b553e |
Source of Spectrum |
APC-342-32-3g |
Synonyms |
N-(1-benzylpiperidin-4-yl)-5-(4-chlorophenylsulfonamido)-1-phenyl-1H-pyrazole-4-carboxamide hydrate |
Wiley ID |
1768971 |