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{[3-cyano-4-(4-methoxyphenyl)-6-(2-thienyl)-2-pyridinyl]sulfanyl}(phenyl)acetic acid
SpectraBase Compound ID FO8C8PKyh7n
InChI InChI=1S/C25H18N2O3S2/c1-30-18-11-9-16(10-12-18)19-14-21(22-8-5-13-31-22)27-24(20(19)15-26)32-23(25(28)29)17-6-3-2-4-7-17/h2-14,23H,1H3,(H,28,29)
InChIKey FMPHCYCAGGIJDZ-UHFFFAOYSA-N
Mol Weight 458.55 g/mol
Molecular Formula C25H18N2O3S2
Exact Mass 458.075885 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6HwtlJCnK0o
Name {[3-cyano-4-(4-methoxyphenyl)-6-(2-thienyl)-2-pyridinyl]sulfanyl}(phenyl)acetic acid
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/C25H18N2O3S2/c1-30-18-11-9-16(10-12-18)19-14-21(22-8-5-13-31-22)27-24(20(19)15-26)32-23(25(28)29)17-6-3-2-4-7-17/h2-14,23H,1H3,(H,28,29)
InChIKey FMPHCYCAGGIJDZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10560
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: 132646; Labnumber: SHES1-205; VK_ID: VK-010564
Temperature 308 °C