SpectraBase Spectrum ID |
KWEV6tuXxPq |
Name |
1-besyl-2-methyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18F3N3O4S |
InChI |
InChI=1S/C18H18F3N3O4S/c1-13-12-22(9-10-23(13)29(27,28)15-5-3-2-4-6-15)16-8-7-14(18(19,20)21)11-17(16)24(25)26/h2-8,11,13H,9-10,12H2,1H3 |
InChIKey |
KDSLHSIESFHIOO-UHFFFAOYSA-N |
Molecular Weight |
429.414 g/mol |
SMILES |
c1ccc(S(N2C(CN(CC2)c2c(N(=O)=O)cc(C(F)(F)F)cc2)C)(=O)=O)cc1 |
SPLASH |
splash10-00bc-9420000000-c16bc214d3ab0fc3c4cf |
Synonyms |
2-Methyl-4-[2-nitro-4-(trifluoromethyl)phenyl]-1-(phenylsulfonyl)piperazine |
Wiley ID |
1464418 |