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ethyl 4-(aminocarbonyl)-5-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methyl-2-thiophenecarboxylate

View entire compound with spectra: 1 NMR

ethyl 4-(aminocarbonyl)-5-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID JQeuRCUARV5
InChI InChI=1S/C17H16F2N6O4S/c1-4-29-16(28)10-7(3)9(12(20)26)15(30-10)23-14(27)13-22-17-21-6(2)5-8(11(18)19)25(17)24-13/h5,11H,4H2,1-3H3,(H2,20,26)(H,23,27)
InChIKey BEAKMTXUXLMEJQ-UHFFFAOYSA-N
Mol Weight 438.41 g/mol
Molecular Formula C17H16F2N6O4S
Exact Mass 438.092181 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A6vuQ3OTJmj
Name ethyl 4-(aminocarbonyl)-5-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methyl-2-thiophenecarboxylate
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/C17H16F2N6O4S/c1-4-29-16(28)10-7(3)9(12(20)26)15(30-10)23-14(27)13-22-17-21-6(2)5-8(11(18)19)25(17)24-13/h5,11H,4H2,1-3H3,(H2,20,26)(H,23,27)
InChIKey BEAKMTXUXLMEJQ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3027
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: 9313727; UBI_ID: UBI-003028
Temperature 308 °C