| SpectraBase Spectrum ID |
Af802TGhnmX |
| Name |
2-(Chloromethyl)-3-[1'-(p-nitrophenyl)-3'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene |
| Comments |
Note: The molecular formula of the structure shown is C21H18ClN3O2S - which differs from the formula reported for the mass spectrum (C21H18ClN3O2S2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18ClN3O2S2 |
| InChI |
InChI=1S/C21H18ClN3O2S/c1-14-11-18(21(13-22)28-14)19-12-20(15-5-3-2-4-6-15)24(23-19)16-7-9-17(10-8-16)25(26)27/h2-11,20H,12-13H2,1H3 |
| InChIKey |
YNKOHNKTVGDZID-UHFFFAOYSA-N |
| Molecular Weight |
411.907 g/mol |
| SMILES |
C1(N(N=C(C1)c1c(sc(c1)C)CCl)c1ccc(N(=O)=O)cc1)c1ccccc1 |
| SPLASH |
splash10-0006-0004900000-be8d40b22957f296b1be |
| Source of Spectrum |
F9-1994-115-6 |
| Synonyms |
2-(Chloromethyl)-3-[1'-(p-nitrophenyl)-5'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene
5-Methyl-3-[1'-(p-nitrophenyl)-5'-phenyl-4',5'-dihydropyrazol-3'-yl]-2-(chloromethyl)thiophene
5-[2-(chloromethyl)-5-methyl-3-thiophenyl]-2-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazole
5-[2-(chloromethyl)-5-methylthiophen-3-yl]-2-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazole
5-[2-(chloromethyl)-5-methyl-3-thienyl]-2-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazole
5-[2-(chloromethyl)-5-methyl-thiophen-3-yl]-2-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazole |
| Wiley ID |
1566848 |
![2-(Chloromethyl)-3-[1'-(p-nitrophenyl)-3'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene](/api/spectrum/Af802TGhnmX/structure.png?h=300&w=458 "2-(Chloromethyl)-3-[1'-(p-nitrophenyl)-3'-phenyl-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene")
