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Methyl 2-{[(2-chloro-7-cyclopropyl-4-oxo-4,7-dihydrothieno[2,3-b]pyridin-5-yl)carbonyl]amino}-3-phenylpropanoate
SpectraBase Compound ID rpeQvkWSC7
InChI InChI=1S/C21H19ClN2O4S/c1-28-21(27)16(9-12-5-3-2-4-6-12)23-19(26)15-11-24(13-7-8-13)20-14(18(15)25)10-17(22)29-20/h2-6,10-11,13,16H,7-9H2,1H3,(H,23,26)
InChIKey INFVCWKAHFHJCP-UHFFFAOYSA-N
Mol Weight 430.91 g/mol
Molecular Formula C21H19ClN2O4S
Exact Mass 430.075406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jck8JbNMHFQ
Name
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Formula C21H19ClN2O4S
InChI InChI=1S/C21H19ClN2O4S/c1-28-21(27)16(9-12-5-3-2-4-6-12)23-19(26)15-11-24(13-7-8-13)20-14(18(15)25)10-17(22)29-20/h2-6,10-11,13,16H,7-9H2,1H3,(H,23,26)
InChIKey INFVCWKAHFHJCP-UHFFFAOYSA-N
Molecular Weight 430.0750
SMILES N(C(Cc1ccccc1)C(OC)=O)C(=O)C1=CN(C2CC2)c2c(C1=O)cc(Cl)s2
SPLASH splash10-0udl-7395000000-f080aa9e8385195368e0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany