| SpectraBase Spectrum ID |
IqCFCSGOQUv |
| Name |
1-(5-{2-[Bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19Cl3N4OS |
| InChI |
InChI=1S/C18H19Cl3N4OS/c1-12(26)25-15(11-14(23-25)13-5-3-2-4-6-13)16-17(21)22-18(27-16)24(9-7-19)10-8-20/h2-6,15H,7-11H2,1H3 |
| InChIKey |
AMBUPHWMPZNWTC-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu-GCMS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ardp.201900351 |
| Molecular Weight |
445.796 g/mol |
| SMILES |
C(C)(=O)N1N=C(CC1c1c(nc(s1)N(CCCl)CCCl)Cl)c1ccccc1 |
| SPLASH |
splash10-0a4i-3009300000-cde40335db793c74d6fd |
| Source of Spectrum |
APC-353-15-6g |
| Wiley ID |
1839659 |
![1-(5-{2-[Bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one](/api/spectrum/IqCFCSGOQUv/structure.png?h=300&w=458 "1-(5-{2-[Bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one")
