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acetamide, N-[4-(aminosulfonyl)phenyl]-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-
SpectraBase Compound ID LlkGNq1CsRA
InChI InChI=1S/C19H13F3N4O3S3/c20-19(21,22)14-8-15(16-2-1-7-30-16)26-18(13(14)9-23)31-10-17(27)25-11-3-5-12(6-4-11)32(24,28)29/h1-8H,10H2,(H,25,27)(H2,24,28,29)
InChIKey PICPXNMTUYRQDN-UHFFFAOYSA-N
Mol Weight 498.51 g/mol
Molecular Formula C19H13F3N4O3S3
Exact Mass 498.010188 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AS9w5xquI9y
Name acetamide, N-[4-(aminosulfonyl)phenyl]-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.010188303 u
Formula C19H13F3N4O3S3
InChI InChI=1S/C19H13F3N4O3S3/c20-19(21,22)14-8-15(16-2-1-7-30-16)26-18(13(14)9-23)31-10-17(27)25-11-3-5-12(6-4-11)32(24,28)29/h1-8H,10H2,(H,25,27)(H2,24,28,29)
InChIKey PICPXNMTUYRQDN-UHFFFAOYSA-N
Molecular Weight 498.513 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5039
Solvent DMSO-d6
Source Vendor ID: NMR/9296413; Lab Info: NKS; Lab Number: NKS-aca0089