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benzamide, N-[4-[[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl]phenyl]-3-methyl-
SpectraBase Compound ID KZ9tGygqK83
InChI InChI=1S/C19H19N3O4S/c1-12-5-4-6-15(11-12)18(23)20-16-7-9-17(10-8-16)27(24,25)22-19-13(2)14(3)21-26-19/h4-11,22H,1-3H3,(H,20,23)
InChIKey ORNDXAWPUIQHPO-UHFFFAOYSA-N
Mol Weight 385.44 g/mol
Molecular Formula C19H19N3O4S
Exact Mass 385.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXOd61SY4OA
Name Benzamide, N-[4-[[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl]phenyl]-3-methyl-
Comments Computed using HOSE algorithm
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Exact Mass 385.109627274 u
Formula C19H19N3O4S
InChI InChI=1S/C19H19N3O4S/c1-12-5-4-6-15(11-12)18(23)20-16-7-9-17(10-8-16)27(24,25)22-19-13(2)14(3)21-26-19/h4-11,22H,1-3H3,(H,20,23)
InChIKey ORNDXAWPUIQHPO-UHFFFAOYSA-N
Molecular Weight 385.438 g/mol
SMILES N(C(C1=CC(C)=CC=C1)=O)C1=CC=C(S(NC2=C(C(C)=NO2)C)(=O)=O)C=C1