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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-7-(2-naphthalenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID GCttZmSPFVo
InChI InChI=1S/C22H18F3N3O2S/c1-30-10-4-9-28-19-18(20(29)27-21(28)31)16(22(23,24)25)12-17(26-19)15-8-7-13-5-2-3-6-14(13)11-15/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,27,29,31)
InChIKey NPVDYUTUNAMOQC-UHFFFAOYSA-N
Mol Weight 445.46 g/mol
Molecular Formula C22H18F3N3O2S
Exact Mass 445.107182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AsgKx6he0CJ
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-7-(2-naphthalenyl)-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/C22H18F3N3O2S/c1-30-10-4-9-28-19-18(20(29)27-21(28)31)16(22(23,24)25)12-17(26-19)15-8-7-13-5-2-3-6-14(13)11-15/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,27,29,31)
InChIKey NPVDYUTUNAMOQC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21811
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: 2141457; UZI_ID: UZI-021819
Temperature 308 °C