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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-chlorophenyl)-1-cyclopentyl-5-(difluoromethyl)-2-mercapto-
SpectraBase Compound ID LEZr9BreXkH
InChI InChI=1S/C19H16ClF2N3OS/c20-11-7-5-10(6-8-11)14-9-13(16(21)22)15-17(23-14)25(12-3-1-2-4-12)19(27)24-18(15)26/h5-9,12,16H,1-4H2,(H,24,26,27)
InChIKey FCCOREULQVFKAW-UHFFFAOYSA-N
Mol Weight 407.87 g/mol
Molecular Formula C19H16ClF2N3OS
Exact Mass 407.067067 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID xkKT22Acw8
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-chlorophenyl)-1-cyclopentyl-5-(difluoromethyl)-2-mercapto-
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/C19H16ClF2N3OS/c20-11-7-5-10(6-8-11)14-9-13(16(21)22)15-17(23-14)25(12-3-1-2-4-12)19(27)24-18(15)26/h5-9,12,16H,1-4H2,(H,24,26,27)
InChIKey FCCOREULQVFKAW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23442
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: 2279007; UZI_ID: UZI-023450
Temperature 308 °C