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3-(2-chlorophenyl)-5-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-isoxazolecarboxamide

View entire compound with spectra: 2 NMR

3-(2-chlorophenyl)-5-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-isoxazolecarboxamide
SpectraBase Compound ID 4Nb8vbvBkaC
InChI InChI=1S/C19H14ClN3O2S/c1-10-7-8-14-15(9-10)26-19(21-14)22-18(24)16-11(2)25-23-17(16)12-5-3-4-6-13(12)20/h3-9H,1-2H3,(H,21,22,24)
InChIKey YUIQTQHKJPXIRS-UHFFFAOYSA-N
Mol Weight 383.85 g/mol
Molecular Formula C19H14ClN3O2S
Exact Mass 383.049526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5kVTDTwtzl3
Name 3-(2-Chlorophenyl)-5-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 383.049525575 u
Formula C19H14ClN3O2S
InChI InChI=1S/C19H14ClN3O2S/c1-10-7-8-14-15(9-10)26-19(21-14)22-18(24)16-11(2)25-23-17(16)12-5-3-4-6-13(12)20/h3-9H,1-2H3,(H,21,22,24)
InChIKey YUIQTQHKJPXIRS-UHFFFAOYSA-N
Molecular Weight 383.853 g/mol
SMILES N(C1=NC2=CC=C(C=C2S1)C)C(C=1C(=NOC1C)C1=C(Cl)C=CC=C1)=O