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Ethyl 2-{[(5-chloro-2-thienyl)carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
SpectraBase Compound ID 3nemQzmG4oN
InChI InChI=1S/C12H11ClN2O3S2/c1-3-18-11(17)9-6(2)14-12(20-9)15-10(16)7-4-5-8(13)19-7/h4-5H,3H2,1-2H3,(H,14,15,16)
InChIKey BZVSDJSIEIWRNC-UHFFFAOYSA-N
Mol Weight 330.8 g/mol
Molecular Formula C12H11ClN2O3S2
Exact Mass 329.989962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IoRIIOCiZUa
Name Ethyl 2-{[(5-chloro-2-thienyl)carbonyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 329.989962267 u
Formula C12H11ClN2O3S2
InChI InChI=1S/C12H11ClN2O3S2/c1-3-18-11(17)9-6(2)14-12(20-9)15-10(16)7-4-5-8(13)19-7/h4-5H,3H2,1-2H3,(H,14,15,16)
InChIKey BZVSDJSIEIWRNC-UHFFFAOYSA-N
Molecular Weight 330.804 g/mol
SMILES N(C=1SC(=C(N1)C)C(=O)OCC)C(C=1SC(Cl)=CC1)=O