| SpectraBase Spectrum ID |
BRV3yWR0PHq |
| Name |
2,5-Dimethyl-6-[1-toluene-4-sulphonyl)-1H-pyrazol-4-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H21N3O4S |
| InChI |
InChI=1S/C20H21N3O4S/c1-12-4-6-15(7-5-12)28(26,27)23-11-14(10-21-23)16-9-18-17(8-13(16)2)19(24)22(3)20(18)25/h4-7,10-11,17-18H,8-9H2,1-3H3/t17-,18+/m0/s1 |
| InChIKey |
CIZQOWXOOBOGKJ-ZWKOTPCHSA-N |
| Molecular Weight |
399.465 g/mol |
| SMILES |
c1n[n](S(c2ccc(cc2)C)(=O)=O)cc1C1=C(C[C@@]2(C(=O)N(C([C@@]2(C1)[H])=O)C)[H])C |
| SPLASH |
splash10-0udi-3092000000-314cfa756da225ead452 |
| Source of Spectrum |
F-57-10353-31 |
| Wiley ID |
1626859 |
![2,5-Dimethyl-6-[1-toluene-4-sulphonyl)-1H-pyrazol-4-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione](/api/spectrum/BRV3yWR0PHq/structure.png?h=300&w=458 "2,5-Dimethyl-6-[1-toluene-4-sulphonyl)-1H-pyrazol-4-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione")
