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Methyl 4-methyl-2-{[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]amino}-1,3-thiazole-5-carboxylate
SpectraBase Compound ID 4uxCiq0EQaF
InChI InChI=1S/C17H15N3O4S/c1-9-14(16(22)23-3)25-17(18-9)19-15(21)12-10(2)24-20-13(12)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,18,19,21)
InChIKey HSNCRNNTHGDGJD-UHFFFAOYSA-N
Mol Weight 357.38 g/mol
Molecular Formula C17H15N3O4S
Exact Mass 357.078327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1cQD7yc7PLF
Name Methyl 4-methyl-2-{[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]amino}-1,3-thiazole-5-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 357.078327145 u
Formula C17H15N3O4S
InChI InChI=1S/C17H15N3O4S/c1-9-14(16(22)23-3)25-17(18-9)19-15(21)12-10(2)24-20-13(12)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,18,19,21)
InChIKey HSNCRNNTHGDGJD-UHFFFAOYSA-N
Molecular Weight 357.384 g/mol
SMILES N(C=1SC(=C(N1)C)C(=O)OC)C(C=1C(=NOC1C)C1=CC=CC=C1)=O