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3-Pyridinecarboxamide, 2-(1,3-benzothiazol-2-yl)-N-(5-methyl-3-isoxazolyl)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Pyridinecarboxamide, 2-(1,3-benzothiazol-2-yl)-N-(5-methyl-3-isoxazolyl)-
SpectraBase Compound ID DvZm6BZSOjJ
InChI InChI=1S/C17H12N4O2S/c1-10-9-14(21-23-10)20-16(22)11-5-4-8-18-15(11)17-19-12-6-2-3-7-13(12)24-17/h2-9H,1H3,(H,20,21,22)
InChIKey GLZGPRUFCREOCF-UHFFFAOYSA-N
Mol Weight 336.37 g/mol
Molecular Formula C17H12N4O2S
Exact Mass 336.068097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1JNm26XEnY
Name 3-Pyridinecarboxamide, 2-(1,3-benzothiazol-2-yl)-N-(5-methyl-3-isoxazolyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.068096814 u
Formula C17H12N4O2S
InChI InChI=1S/C17H12N4O2S/c1-10-9-14(21-23-10)20-16(22)11-5-4-8-18-15(11)17-19-12-6-2-3-7-13(12)24-17/h2-9H,1H3,(H,20,21,22)
InChIKey GLZGPRUFCREOCF-UHFFFAOYSA-N
Molecular Weight 336.369 g/mol
SMILES C1(=NC=2C=CC=CC2S1)C1=C(C(NC2=NOC(=C2)C)=O)C=CC=N1