SpectraBase Spectrum ID |
3Qy2rJuzYxC |
Name |
Carbamic acid, [4-[3-benzoyl-2-(1,1-dimethylethyl)-4-(1-hydroxyethyl)-1-methyl-5-oxo-4-imidazolidinyl]butyl]-, phenylmethyl ester, [2S-[2.alpha.,4.beta.(S*)]]- |
CAS Registry Number |
116139-81-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H39N3O5 |
InChI |
InChI=1S/C29H39N3O5/c1-21(33)29(18-12-13-19-30-27(36)37-20-22-14-8-6-9-15-22)26(35)31(5)25(28(2,3)4)32(29)24(34)23-16-10-7-11-17-23/h6-11,14-17,21,25,33H,12-13,18-20H2,1-5H3,(H,30,36)/t21-,25?,29?/m1/s1 |
InChIKey |
KIKDOYNQJLPVKE-KQACFBEISA-N |
Molecular Weight |
509.647 g/mol |
SMILES |
O[C@@](C1(CCCCNC(=O)OCc2ccccc2)N(C(N(C)C1=O)C(C)(C)C)C(=O)c1ccccc1)(C)[H] |
SPLASH |
splash10-0a4l-9700000000-69edc59e7ed666bb9b08 |
Source of Spectrum |
H-71-232-15 |
Synonyms |
(2S,5S)-1-Benzoyl-5-{4'-(benzyloxycarbonyl)amino]butyl}-2-t-butyl-5-(1''-hydroxyethyl)-3-methyl-4-imidazolidone
benzyl 4-{3-benzoyl-2-tert-butyl-4-[(1R)-1-hydroxyethyl]-1-methyl-5-oxo-4-imidazolidinyl}butylcarbamate |
Wiley ID |
1400386 |