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2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

View entire compound with spectra: 1 NMR

2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
SpectraBase Compound ID IrLdEQYoq4u
InChI InChI=1S/C27H24ClN3O4S/c1-27(2)13-22-17(14-35-27)12-21-24(29-22)30-26(36-15-23(32)16-4-6-18(28)7-5-16)31(25(21)33)19-8-10-20(34-3)11-9-19/h4-12H,13-15H2,1-3H3
InChIKey SHXSRRGSQIMLJS-UHFFFAOYSA-N
Mol Weight 522.02 g/mol
Molecular Formula C27H24ClN3O4S
Exact Mass 521.117605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6kZrjM77ZFS
Name 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
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/C27H24ClN3O4S/c1-27(2)13-22-17(14-35-27)12-21-24(29-22)30-26(36-15-23(32)16-4-6-18(28)7-5-16)31(25(21)33)19-8-10-20(34-3)11-9-19/h4-12H,13-15H2,1-3H3
InChIKey SHXSRRGSQIMLJS-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11982
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: 800803; Labnumber: AE95-493; VK_ID: VK-011987
Temperature 308 °C