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Ethyl 2-([(dodecylsulfanyl)acetyl]amino)-4-methyl-1,3-thiazole-5-carboxylate
SpectraBase Compound ID CFepESDyYiq
InChI InChI=1S/C21H36N2O3S2/c1-4-6-7-8-9-10-11-12-13-14-15-27-16-18(24)23-21-22-17(3)19(28-21)20(25)26-5-2/h4-16H2,1-3H3,(H,22,23,24)
InChIKey JNWNFMIKDYFEHG-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C21H36N2O3S2
Exact Mass 428.216735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkszlLSMa2P
Name Ethyl 2-([(dodecylsulfanyl)acetyl]amino)-4-methyl-1,3-thiazole-5-carboxylate
CAS Registry Number 349572-29-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36N2O3S2
InChI InChI=1S/C21H36N2O3S2/c1-4-6-7-8-9-10-11-12-13-14-15-27-16-18(24)23-21-22-17(3)19(28-21)20(25)26-5-2/h4-16H2,1-3H3,(H,22,23,24)
InChIKey JNWNFMIKDYFEHG-UHFFFAOYSA-N
Molecular Weight 428.650 g/mol
SMILES N(c1nc(c(s1)C(=O)OCC)C)C(=O)CSCCCCCCCCCCCC
SPLASH splash10-000f-9520000000-5e780cded4f082da2ae9
Synonyms 2-[[2-(dodecylthio)-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester 2-[[2-(laurylthio)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Ethyl 2-(2-dodecylsulfanylethanoylamino)-4-methyl-1,3-thiazole-5-carboxylate Ethyl 2-[(2-dodecylsulfanylacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Ethyl 2-[(2-dodecylsulfanylacetyl)amino]-4-methyl-thiazole-5-carboxylate Ethyl 2-[2-(dodecylthio)acetamido]-4-methyl-5-thiazolecarboxylate
Wiley ID 1467687