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(2E)-N-[5-(4-methoxyphenyl)-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-phenyl-2-propenamide
SpectraBase Compound ID 4qKiTfwgf2L
InChI InChI=1S/C27H25N5O2/c1-34-22-15-13-20(14-16-22)23-18-24(21-10-6-3-7-11-21)32-27(28-23)30-26(31-32)29-25(33)17-12-19-8-4-2-5-9-19/h2-17,23-24H,18H2,1H3,(H2,28,29,30,31,33)/b17-12+
InChIKey FDTUOTKYSIAMSL-SFQUDFHCSA-N
Mol Weight 451.53 g/mol
Molecular Formula C27H25N5O2
Exact Mass 451.200825 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1GJTItiMVRO
Name (2E)-N-[5-(4-methoxyphenyl)-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-phenyl-2-propenamide
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/C27H25N5O2/c1-34-22-15-13-20(14-16-22)23-18-24(21-10-6-3-7-11-21)32-27(28-23)30-26(31-32)29-25(33)17-12-19-8-4-2-5-9-19/h2-17,23-24H,18H2,1H3,(H2,28,29,30,31,33)/b17-12+
InChIKey FDTUOTKYSIAMSL-SFQUDFHCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22445
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: D59550; Labnumber: RRVCHEx-0504; SBI_ID: SBI-022449
Synonyms N-[5-(4-methoxyphenyl)-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-phenyl-2-propenamide
Temperature 318 °C