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9-(difluoromethyl)-7-methyl-2-{1-[(3-nitrophenyl)sulfonyl]-4-piperidinyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID 9mGBzvdYcEC
InChI InChI=1S/C23H19F2N7O4S2/c1-12-9-16(20(24)25)27-23-17(12)18-19(37-23)22-28-21(29-31(22)11-26-18)13-5-7-30(8-6-13)38(35,36)15-4-2-3-14(10-15)32(33)34/h2-4,9-11,13,20H,5-8H2,1H3
InChIKey JUTUNBDVBSOJDZ-UHFFFAOYSA-N
Mol Weight 559.57 g/mol
Molecular Formula C23H19F2N7O4S2
Exact Mass 559.090801 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4kWDdjQYkF9
Name 9-(difluoromethyl)-7-methyl-2-{1-[(3-nitrophenyl)sulfonyl]-4-piperidinyl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
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/C23H19F2N7O4S2/c1-12-9-16(20(24)25)27-23-17(12)18-19(37-23)22-28-21(29-31(22)11-26-18)13-5-7-30(8-6-13)38(35,36)15-4-2-3-14(10-15)32(33)34/h2-4,9-11,13,20H,5-8H2,1H3
InChIKey JUTUNBDVBSOJDZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33203
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: 1912200; SBI_ID: SBI-033207
Temperature 306 °C