SpectraBase Spectrum ID |
EvI10LUCpCa |
Name |
N-(2-PYRIMIDINYL)-4-[2,2,2-TRIFLUORO-1-ISOVALERAMIDO-1- |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C18H19F6N5O3S |
InChI |
InChI=1S/C18H19F6N5O3S/c1-11(2)10-14(30)28-16(17(19,20)21,18(22,23)24)27-12-4-6-13(7-5-12)33(31,32)29-15-25-8-3-9-26-15/h3-9,11,27H,10H2,1-2H3,(H,28,30)(H,25,26,29) |
InChIKey |
CPAKZZASGNMFCD-UHFFFAOYSA-N |
Molecular Weight |
499.1109 |
SMILES |
N(S(c1ccc(NC(NC(CC(C)C)=O)(C(F)(F)F)C(F)(F)F)cc1)(=O)=O)c1ncccn1 |
SPLASH |
splash10-053f-9201000000-eb210ff541ac3fc53b23 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |