SpectraBase Spectrum ID |
2d6phjxcrU1 |
Name |
AB-CHMFUPPYCA |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H29FN4O2 |
InChI |
InChI=1S/C22H29FN4O2/c1-14(2)20(21(24)28)25-22(29)18-12-19(16-8-10-17(23)11-9-16)27(26-18)13-15-6-4-3-5-7-15/h8-12,14-15,20H,3-7,13H2,1-2H3,(H2,24,28)(H,25,29)/t20-/m0/s1 |
InChIKey |
XMZXGVYPIIOHAQ-FQEVSTJZSA-N |
Molecular Weight |
400.498 g/mol |
SMILES |
N(C(c1n[n](c(-c2ccc(cc2)F)c1)CC1CCCCC1)=O)[C@](C(N)=O)(C(C)C)[H] |
SPLASH |
splash10-0a4i-5690000000-db30daf4f75b1d129e71 |
Source of Spectrum |
SWG-33-4473-0 |
Synonyms |
AB-CHFUPYCA
N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(cyclohexylmethyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
5,3-AB-CHMFUPPYCA
(S)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(cyclohexylmethyl)-5-(4-fluorophenyl)-1H-pyrazole-3-carboxamide |
Wiley ID |
1811075 |