| SpectraBase Spectrum ID |
62qHv28jwLJ |
| Name |
3-(Benzo[d][1,3]dioxol-5-yl)-5-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-4,5-dihydro-1H-pyrazole-1-carbaldehyde |
| Appearance |
Beige solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17Cl3N4O3S |
| InChI |
InChI=1S/C18H17Cl3N4O3S/c19-3-5-24(6-4-20)18-22-17(21)16(29-18)13-8-12(23-25(13)9-26)11-1-2-14-15(7-11)28-10-27-14/h1-2,7,9,13H,3-6,8,10H2 |
| InChIKey |
BPISYZDZTSLCJE-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu-GCMS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ardp.201900351 |
| Molecular Weight |
475.778 g/mol |
| SMILES |
C1(=NN(C(C1)c1c(nc(s1)N(CCCl)CCCl)Cl)C=O)c1ccc2c(OCO2)c1 |
| SPLASH |
splash10-05mo-9200100000-d83ee6662e20a73f7e2f |
| Source of Spectrum |
APC-353-16-7d |
| Wiley ID |
1839663 |
![3-(Benzo[d][1,3]dioxol-5-yl)-5-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-4,5-dihydro-1H-pyrazole-1-carbaldehyde](/api/spectrum/62qHv28jwLJ/structure.png?h=300&w=458 "3-(Benzo[d][1,3]dioxol-5-yl)-5-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}-4,5-dihydro-1H-pyrazole-1-carbaldehyde")
