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N-[1-[[1-(4-hydroxybenzyl)-2-(N'-isopropylidenehydrazino)-2-keto-ethyl]carbamoyl]-3-(methylthio)propyl]carbamic acid tert-butyl ester
SpectraBase Compound ID EjqftPKJa2S
InChI InChI=1S/C22H34N4O5S/c1-14(2)25-26-20(29)18(13-15-7-9-16(27)10-8-15)23-19(28)17(11-12-32-6)24-21(30)31-22(3,4)5/h7-10,17-18,27H,11-13H2,1-6H3,(H,23,28)(H,24,30)(H,26,29)
InChIKey JFXXWPKLSOJYQO-UHFFFAOYSA-N
Mol Weight 466.6 g/mol
Molecular Formula C22H34N4O5S
Exact Mass 466.224991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hTSe6vdIlW
Name N-[1-[[1-(4-hydroxybenzyl)-2-(N'-isopropylidenehydrazino)-2-keto-ethyl]carbamoyl]-3-(methylthio)propyl]carbamic acid tert-butyl ester
CAS Registry Number 322682-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34N4O5S
InChI InChI=1S/C22H34N4O5S/c1-14(2)25-26-20(29)18(13-15-7-9-16(27)10-8-15)23-19(28)17(11-12-32-6)24-21(30)31-22(3,4)5/h7-10,17-18,27H,11-13H2,1-6H3,(H,23,28)(H,24,30)(H,26,29)
InChIKey JFXXWPKLSOJYQO-UHFFFAOYSA-N
Molecular Weight 466.597 g/mol
SMILES N(N=C(C)C)C(C(Cc1ccc(cc1)O)NC(C(CCSC)NC(=O)OC(C)(C)C)=O)=O
SPLASH splash10-0a4i-9610000000-58d32fad80bcc4b9e2bb
Synonyms N-[1-[[3-(4-hydroxyphenyl)-1-oxo-1-(2-propan-2-ylidenehydrazinyl)propan-2-yl]amino]-4-(methylthio)-1-oxobutan-2-yl]carbamic acid tert-butyl ester N.alpha.-[N-(tert-butoxycarbonyl)methionyl]tyrosine N'-isopropylidenehydrazide tert-Butyl 1-[((1-(4-hydroxybenzyl)-2-[2-(1-methylethylidene)hydrazino]-2-oxoethyl)amino)carbonyl]-3-(methylsulfanyl)propylcarbamate tert-Butyl N-[1-[[1-[(4-hydroxyphenyl)methyl]-2-(2-isopropylidenehydrazino)-2-oxo-ethyl]carbamoyl]-3-methylsulfanyl-propyl]carbamate tert-Butyl N-[1-[[3-(4-hydroxyphenyl)-1-oxidanylidene-1-(2-propan-2-ylidenehydrazinyl)propan-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]carbamate tert-Butyl N-[1-[[3-(4-hydroxyphenyl)-1-oxo-1-(2-propan-2-ylidenehydrazinyl)propan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamate
Wiley ID 1467421