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pyrido[2,3-d]pyrimidin-4(1H)-one, 1-cyclopentyl-2-mercapto-7-(2-methoxyphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID GorVI5hTe6c
InChI InChI=1S/C20H18F3N3O2S/c1-28-15-9-5-4-8-12(15)14-10-13(20(21,22)23)16-17(24-14)26(11-6-2-3-7-11)19(29)25-18(16)27/h4-5,8-11H,2-3,6-7H2,1H3,(H,25,27,29)
InChIKey LQUNCGSAOLYIMF-UHFFFAOYSA-N
Mol Weight 421.44 g/mol
Molecular Formula C20H18F3N3O2S
Exact Mass 421.107182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7fIjsLkVfJp
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-cyclopentyl-2-mercapto-7-(2-methoxyphenyl)-5-(trifluoromethyl)-
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/C20H18F3N3O2S/c1-28-15-9-5-4-8-12(15)14-10-13(20(21,22)23)16-17(24-14)26(11-6-2-3-7-11)19(29)25-18(16)27/h4-5,8-11H,2-3,6-7H2,1H3,(H,25,27,29)
InChIKey LQUNCGSAOLYIMF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23285
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: 2278356; UZI_ID: UZI-023293
Temperature 308 °C