| SpectraBase Spectrum ID |
4OLTvaFB2Vb |
| Name |
1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(2-hydroxy-phenyl)-5-(2-butyl-4-chloro-1H-imidazol-5yl)-2-pyrazoline |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H23Cl2N5OS |
| InChI |
InChI=1S/C25H23Cl2N5OS/c1-2-3-8-22-29-23(24(27)30-22)20-13-18(17-6-4-5-7-21(17)33)31-32(20)25-28-19(14-34-25)15-9-11-16(26)12-10-15/h4-7,9-12,14,20,33H,2-3,8,13H2,1H3,(H,29,30) |
| InChIKey |
HKFLMEHDGGIIFI-UHFFFAOYSA-N |
| Molecular Weight |
512.459 g/mol |
| SMILES |
[nH]1c(nc(c1C1N(N=C(c2c(cccc2)O)C1)c1nc(-c2ccc(cc2)Cl)cs1)Cl)CCCC |
| SPLASH |
splash10-03di-0000090000-83ce0140cb6dc981c685 |
| Source of Spectrum |
F2-45-391-3m |
| Wiley ID |
1688820 |
