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2-thiophenecarboxylic acid, 5-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-4-cyano-3-methyl-, methyl ester

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2-thiophenecarboxylic acid, 5-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-4-cyano-3-methyl-, methyl ester
SpectraBase Compound ID 7PKtYfFs53n
InChI InChI=1S/C19H14ClN3O4S/c1-9-12(8-21)18(28-16(9)19(25)26-3)22-17(24)14-10(2)27-23-15(14)11-6-4-5-7-13(11)20/h4-7H,1-3H3,(H,22,24)
InChIKey KVPRQYKENPORKB-UHFFFAOYSA-N
Mol Weight 415.85 g/mol
Molecular Formula C19H14ClN3O4S
Exact Mass 415.039355 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E8iIBHu1bsU
Name 2-thiophenecarboxylic acid, 5-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-4-cyano-3-methyl-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H14ClN3O4S/c1-9-12(8-21)18(28-16(9)19(25)26-3)22-17(24)14-10(2)27-23-15(14)11-6-4-5-7-13(11)20/h4-7H,1-3H3,(H,22,24)
InChIKey KVPRQYKENPORKB-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3625
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: NMR/10228532