SpectraBase Spectrum ID |
AdMSgp2dkTB |
Name |
cis/trans-3-[3'-Methoxyphenyl]-2-(3'-thienl)methyl-1-(2'-iodobenzoyl)-5-phenylpyrazolidine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H25IN2O2S |
InChI |
InChI=1S/C28H25IN2O2S/c1-33-23-11-7-10-22(16-23)26-17-27(21-8-3-2-4-9-21)31(30(26)18-20-14-15-34-19-20)28(32)24-12-5-6-13-25(24)29/h2-16,19,26-27H,17-18H2,1H3 |
InChIKey |
NWAFSJVTOPPXHB-UHFFFAOYSA-N |
Molecular Weight |
580.484 g/mol |
SMILES |
C1(N(N(C(C1)c1ccccc1)C(c1c(I)cccc1)=O)Cc1cscc1)c1cc(OC)ccc1 |
SPLASH |
splash10-0002-9045000000-f92d4a5cd856263cad08 |
Source of Spectrum |
F-59-4465-50 |
Wiley ID |
1678350 |