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tert-butyl [5-(2-benzylaminopyridin-4-yl-ethynyl)thiazol-4-yl]carbamate
SpectraBase Compound ID Laio5cLJ1fx
InChI InChI=1S/C22H22N4O2S/c1-22(2,3)28-21(27)26-20-18(29-15-25-20)10-9-16-11-12-23-19(13-16)24-14-17-7-5-4-6-8-17/h4-8,11-13,15H,14H2,1-3H3,(H,23,24)(H,26,27)
InChIKey KPZKFCZJJXBYGL-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C22H22N4O2S
Exact Mass 406.146347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZSYtG3ftMG
Name tert-butyl [5-(2-benzylaminopyridin-4-yl-ethynyl)thiazol-4-yl]carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N4O2S
InChI InChI=1S/C22H22N4O2S/c1-22(2,3)28-21(27)26-20-18(29-15-25-20)10-9-16-11-12-23-19(13-16)24-14-17-7-5-4-6-8-17/h4-8,11-13,15H,14H2,1-3H3,(H,23,24)(H,26,27)
InChIKey KPZKFCZJJXBYGL-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 406.504 g/mol
SMILES N(C(=O)OC(C)(C)C)c1c(C#Cc2cc(ncc2)NCc2ccccc2)scn1
SPLASH splash10-0a4i-5904300000-ae865f9bf13e72a23e66
Source of Spectrum US2012252759A1
Wiley ID 1845161