SpectraBase Spectrum ID |
FmYOSS1zaqK |
Name |
N-[3-(Cyclohexylamino)propyl]-2-[[(4-fluorophenyl)sulfonyl]amino]-1,3-thiazol-4-yl-acetamide semihydrate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H29FN4O4S2 |
InChI |
InChI=1S/C20H27FN4O3S2.H2O/c21-15-7-9-18(10-8-15)30(27,28)25-20-24-17(14-29-20)13-19(26)23-12-4-11-22-16-5-2-1-3-6-16;/h7-10,14,16,22H,1-6,11-13H2,(H,23,26)(H,24,25);1H2 |
InChIKey |
SFEPOHWLSMPUPX-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/ardp.200700046 |
Molecular Weight |
472.594 g/mol |
SMILES |
O.N(S(c1ccc(cc1)F)(=O)=O)c1nc(CC(=O)NCCCNC2CCCCC2)cs1 |
SPLASH |
splash10-06r2-6900300000-5e51b518bc5264da1f90 |
Source of Spectrum |
APC-341-650-3a |
Synonyms |
N-(3-(cyclohexylamino)propyl)-2-(2-(4-fluorophenylsulfonamido)thiazol-4-yl)acetamide hydrate |
Wiley ID |
1768893 |