| SpectraBase Spectrum ID |
7CTURtbW8lJ |
| Name |
(S)-1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[(methyl-oxo-phenyl-.lambda.6-sulfanylidene)amino]phenyl]thiourea |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H17F6N3OS2 |
| InChI |
InChI=1S/C22H17F6N3OS2/c1-34(32,17-7-3-2-4-8-17)31-19-10-6-5-9-18(19)30-20(33)29-16-12-14(21(23,24)25)11-15(13-16)22(26,27)28/h2-13H,1H3,(H2,29,30,33)/t34-/m0/s1 |
| InChIKey |
LTZUVYRACRUHTA-UMSFTDKQSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.8.164 |
| Molecular Weight |
517.508 g/mol |
| Optical Rotation |
[a]D = -40.0 (c = 1.6, CHCl3) |
| SMILES |
N(c1ccccc1N=[S@](c1ccccc1)(=O)C)C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=S |
| SPLASH |
splash10-05bf-0977020000-19a5b1ff0f65f490c1e5 |
| Source of Spectrum |
BJO-8-SM4-S-12 |
| Wiley ID |
1864994 |
![(S)-1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[(methyl-oxo-phenyl-.lambda.6-sulfanylidene)amino]phenyl]thiourea](/api/spectrum/7CTURtbW8lJ/structure.png?h=300&w=458 "(S)-1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[(methyl-oxo-phenyl-.lambda.6-sulfanylidene)amino]phenyl]thiourea")
