SpectraBase Spectrum ID |
KD6Q1U00NyJ |
Name |
cis-3-[4'-(Dimethylamino)phenyl]-2-(3'-thienyl)methyl-1-(2'-iodobenzoyl)-5-phenylpyrazolidine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H28IN3OS |
InChI |
InChI=1S/C29H28IN3OS/c1-31(2)24-14-12-23(13-15-24)27-18-28(22-8-4-3-5-9-22)33(32(27)19-21-16-17-35-20-21)29(34)25-10-6-7-11-26(25)30/h3-17,20,27-28H,18-19H2,1-2H3/t27-,28+/m0/s1 |
InChIKey |
AURYMDZOYSLWQK-WUFINQPMSA-N |
Molecular Weight |
593.527 g/mol |
SMILES |
[C@]1(N(N([C@](C1)(c1ccccc1)[H])C(c1c(I)cccc1)=O)Cc1cscc1)(c1ccc(cc1)N(C)C)[H] |
SPLASH |
splash10-001j-7193000000-5f32fabefd31644b43fd |
Source of Spectrum |
F-59-4464-46a |
Wiley ID |
1678355 |