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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
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 JV245abwraH
Name 2-[(2-chloro-7-cyclopropyl-4-keto-thieno[2,3-b]pyridine-5-carbonyl)amino]-4-(methylthio)butyric acid methyl ester
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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 414.922 g/mol
SMILES N(C(C=1C(c2c(N(C1)C1CC1)sc(c2)Cl)=O)=O)C(C(=O)OC)CCSC
SPLASH splash10-0f6x-9264000000-54a597ff3facdc8ef421
Synonyms 2-[[(2-chloro-7-cyclopropyl-4-oxo-5-thieno[2,3-b]pyridinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester Methyl 2-([(2-chloro-7-cyclopropyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridin-5-yl)carbonyl]amino)-4-(methylsulfanyl)butanoate Methyl 2-[(2-chloranyl-7-cyclopropyl-4-oxidanylidene-thieno[2,3-b]pyridin-5-yl)carbonylamino]-4-methylsulfanyl-butanoate Methyl 2-[(2-chloro-7-cyclopropyl-4-oxo-thieno[2,3-b]pyridine-5-carbonyl)amino]-4-methylsulfanyl-butanoate Thieno[2,3-b]pyridin-4(7H)one-5-carboxamide, 2-chloro-7-cyclopropyl-N-[1-acetoxy-3-(methylthio)propyl]-
Wiley ID 1474247