SpectraBase Spectrum ID |
DU94fIwUule |
Name |
Carbamic acid, [4-[3-benzoyl-2-(1,1-dimethylethyl)-1-methyl-5-oxo-4-imidazolidinyl]butyl]-, phenylmethyl ester, (2S-trans)- |
CAS Registry Number |
116139-69-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H35N3O4 |
InChI |
InChI=1S/C27H35N3O4/c1-27(2,3)25-29(4)24(32)22(30(25)23(31)21-15-9-6-10-16-21)17-11-12-18-28-26(33)34-19-20-13-7-5-8-14-20/h5-10,13-16,22,25H,11-12,17-19H2,1-4H3,(H,28,33)/t22-,25-/m0/s1 |
InChIKey |
OMMBBJSIXRIVCS-DHLKQENFSA-N |
Molecular Weight |
465.594 g/mol |
SMILES |
N(C(=O)OCc1ccccc1)CCCC[C@]1(C(=O)N([C@@](N1C(=O)c1ccccc1)(C(C)(C)C)[H])C)[H] |
SPLASH |
splash10-0a6r-7901100000-5ad5b1f3d06f1f8e3ab8 |
Source of Spectrum |
H-71-231-9 |
Synonyms |
(2S,5S)-1-Benzoyl-5-{4'-[benzyloxycarbonyl)amino]butyl}-2-t-butyl-3-methyl-4-imidazolidone
benzyl 4-[(2S,4S)-3-benzoyl-2-tert-butyl-1-methyl-5-oxoimidazolidinyl]butylcarbamate |
Wiley ID |
1391754 |