| SpectraBase Spectrum ID |
8QDLLRPo9i0 |
| Name |
(4S,5S)-N-3,5-Bis(trifluoromethyl)phenyl-N'-[2,2-dimethyl-4-methyl-5-N-(benzyl)methylamine-1,3-dioxolane]thiourea |
| Alternate Name(s) |
1-[(4S,5S)-5-(Benzylamino-methyl)-2,2-dimethyl-[1,3]dioxolan-4-ylmethyl]-3-(3,5-bis-trifluoromethyl-phenyl)-thiourea
1-(((4S,5S)-5-((benzylamino)methyl)-2,2-dimethyl-1,3-dioxolan-4-yl)methyl)-3-(3,5-bis(trifluoromethyl)phenyl)thiourea |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H25F6N3O2S |
| InChI |
InChI=1S/C23H25F6N3O2S/c1-21(2)33-18(12-30-11-14-6-4-3-5-7-14)19(34-21)13-31-20(35)32-17-9-15(22(24,25)26)8-16(10-17)23(27,28)29/h3-10,18-19,30H,11-13H2,1-2H3,(H2,31,32,35)/t18-,19-/m0/s1 |
| InChIKey |
PFAMWSOGXJETOP-OALUTQOASA-N |
| Molecular Weight |
521.522 g/mol |
| SMILES |
N(C(NC[C@@]1(OC(O[C@]1(CNCc1ccccc1)[H])(C)C)[H])=S)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
| SPLASH |
splash10-00di-8980160000-74e3f4cadb50c265769b |
| Source of Spectrum |
F4-44-3213-17 |
| Wiley ID |
1736807 |
![(4S,5S)-N-3,5-Bis(trifluoromethyl)phenyl-N'-[2,2-dimethyl-4-methyl-5-N-(benzyl)methylamine-1,3-dioxolane]thiourea](/api/spectrum/8QDLLRPo9i0/structure.png?h=300&w=458 "(4S,5S)-N-3,5-Bis(trifluoromethyl)phenyl-N'-[2,2-dimethyl-4-methyl-5-N-(benzyl)methylamine-1,3-dioxolane]thiourea")
