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5-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
SpectraBase Compound ID 26i0t5gp6Hw
InChI InChI=1S/C23H18N6O4S/c1-13-3-8-19-20(9-13)34-23(26-19)15-4-6-16(7-5-15)25-22(30)21-18(14(2)33-27-21)12-28-11-17(10-24-28)29(31)32/h3-11H,12H2,1-2H3,(H,25,30)
InChIKey URALHIURVHXJPR-UHFFFAOYSA-N
Mol Weight 474.5 g/mol
Molecular Formula C23H18N6O4S
Exact Mass 474.111024 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7tMDItkJXIV
Name 5-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H18N6O4S/c1-13-3-8-19-20(9-13)34-23(26-19)15-4-6-16(7-5-15)25-22(30)21-18(14(2)33-27-21)12-28-11-17(10-24-28)29(31)32/h3-11H,12H2,1-2H3,(H,25,30)
InChIKey URALHIURVHXJPR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33081
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1912010; SBI_ID: SBI-033085
Temperature 318 °C