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7-(difluoromethyl)-N-{4-[(4-methoxyanilino)sulfonyl]phenyl}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID CfaRzsa3e6C
InChI InChI=1S/C21H18F2N6O4S/c1-12-11-17(18(22)23)29-21(24-12)26-19(27-29)20(30)25-13-5-9-16(10-6-13)34(31,32)28-14-3-7-15(33-2)8-4-14/h3-11,18,28H,1-2H3,(H,25,30)
InChIKey OHMGSQUENLTRID-UHFFFAOYSA-N
Mol Weight 488.47 g/mol
Molecular Formula C21H18F2N6O4S
Exact Mass 488.107831 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7HVXwkuyTGm
Name 7-(difluoromethyl)-N-{4-[(4-methoxyanilino)sulfonyl]phenyl}-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
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/C21H18F2N6O4S/c1-12-11-17(18(22)23)29-21(24-12)26-19(27-29)20(30)25-13-5-9-16(10-6-13)34(31,32)28-14-3-7-15(33-2)8-4-14/h3-11,18,28H,1-2H3,(H,25,30)
InChIKey OHMGSQUENLTRID-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1452
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: 9311913; UBI_ID: UBI-001453
Temperature 313 °C