| SpectraBase Spectrum ID |
ImopAfpIDr |
| Name |
Threo-N-(2-((2,5-dioxopyrrolidin-1-yl)methyl)-1-(4-nitrophenyl)-3-oxobutyl)-4-methylbenzenesulfonamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H23N3O7S |
| InChI |
InChI=1S/C22H23N3O7S/c1-14-3-9-18(10-4-14)33(31,32)23-22(16-5-7-17(8-6-16)25(29)30)19(15(2)26)13-24-20(27)11-12-21(24)28/h3-10,19,22-23H,11-13H2,1-2H3/t19-,22+/m1/s1 |
| InChIKey |
NMUSNPGCZYBZBX-KNQAVFIVSA-N |
| Molecular Weight |
473.500 g/mol |
| SMILES |
N([C@@](c1ccc(cc1)[N+](=O)[O-])([C@@](C(C)=O)(CN1C(CCC1=O)=O)[H])[H])S(=O)(=O)c1ccc(cc1)C |
| SPLASH |
splash10-0aor-0932000000-1f65abf85262632ad68d |
| Source of Spectrum |
J-76-2888/SMS34-threo_6c |
| Synonyms |
N-((1R,2S)-2-((2,5-dioxopyrrolidin-1-yl)methyl)-1-(4-nitrophenyl)-3-oxobutyl)-4-methylbenzenesulfonamide |
| Wiley ID |
1755567 |
