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methyl 2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

View entire compound with spectra: 1 NMR

methyl 2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID ANpemESoP5T
InChI InChI=1S/C17H15F2N5O3S/c1-7-6-9(12(18)19)24-17(20-7)21-13(23-24)14(25)22-15-11(16(26)27-2)8-4-3-5-10(8)28-15/h6,12H,3-5H2,1-2H3,(H,22,25)
InChIKey VYARVHXWEUOOJL-UHFFFAOYSA-N
Mol Weight 407.4 g/mol
Molecular Formula C17H15F2N5O3S
Exact Mass 407.086367 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5rcNAnXWOUR
Name methyl 2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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/C17H15F2N5O3S/c1-7-6-9(12(18)19)24-17(20-7)21-13(23-24)14(25)22-15-11(16(26)27-2)8-4-3-5-10(8)28-15/h6,12H,3-5H2,1-2H3,(H,22,25)
InChIKey VYARVHXWEUOOJL-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1463
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: 9311372; UBI_ID: UBI-001464
Temperature 313 °C