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2-[(2-chloro-7-cyclopropyl-4-keto-thieno[2,3-b]pyridine-5-carbonyl)amino]-4-(methylthio)butyric acid methyl ester

View entire compound with spectra: 2 MS (GC)

2-[(2-chloro-7-cyclopropyl-4-keto-thieno[2,3-b]pyridine-5-carbonyl)amino]-4-(methylthio)butyric acid methyl ester
SpectraBase Compound ID 64K3uOxrnaM
InChI InChI=1S/C17H19ClN2O4S2/c1-24-17(23)12(5-6-25-2)19-15(22)11-8-20(9-3-4-9)16-10(14(11)21)7-13(18)26-16/h7-9,12H,3-6H2,1-2H3,(H,19,22)
InChIKey IWHUJLORPIUQKH-UHFFFAOYSA-N
Mol Weight 414.92 g/mol
Molecular Formula C17H19ClN2O4S2
Exact Mass 414.047477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FO0VJb249Yt
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H19ClN2O4S2
InChI InChI=1S/C17H19ClN2O4S2/c1-24-17(23)12(5-6-25-2)19-15(22)11-8-20(9-3-4-9)16-10(14(11)21)7-13(18)26-16/h7-9,12H,3-6H2,1-2H3,(H,19,22)
InChIKey IWHUJLORPIUQKH-UHFFFAOYSA-N
Molecular Weight 414.0471
SMILES N(C(CCSC)C(OC)=O)C(=O)C1=CN(C2CC2)c2sc(Cl)cc2C1=O
SPLASH splash10-0f6x-9264000000-529fbb2b0171312e6fe7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany