| SpectraBase Spectrum ID |
FPB2V71qjth |
| Name |
1-(4-(4'-chlorophenyl)-2-thiazolyl)-3-(5-chloro-2-hydroxyphenyl)-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 |
C25H22Cl3N5OS |
| InChI |
InChI=1S/C25H22Cl3N5OS/c1-2-3-4-22-30-23(24(28)31-22)20-12-18(17-11-16(27)9-10-21(17)34)32-33(20)25-29-19(13-35-25)14-5-7-15(26)8-6-14/h5-11,13,20,34H,2-4,12H2,1H3,(H,30,31) |
| InChIKey |
OBMLPGPUZRCJBZ-UHFFFAOYSA-N |
| Molecular Weight |
546.904 g/mol |
| SMILES |
[nH]1c(nc(c1C1N(N=C(c2c(ccc(c2)Cl)O)C1)c1nc(-c2ccc(cc2)Cl)cs1)Cl)CCCC |
| SPLASH |
splash10-0002-0000090000-7f91575cc90c6ffa1c6f |
| Source of Spectrum |
F2-45-390-3a |
| Wiley ID |
1688830 |
