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6-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

View entire compound with spectra: 1 NMR

6-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID 9shsCpZv1rL
InChI InChI=1S/C23H21ClN4OS/c1-12-8-13(2)18(9-15(12)11-30-17-6-4-16(24)5-7-17)21-19(10-25)22(26)29-23-20(21)14(3)27-28-23/h4-9,21H,11,26H2,1-3H3,(H,27,28)
InChIKey XLZAAPSGZWXJTQ-UHFFFAOYSA-N
Mol Weight 436.96 g/mol
Molecular Formula C23H21ClN4OS
Exact Mass 436.11246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6FmHh6xwIEn
Name 6-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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/C23H21ClN4OS/c1-12-8-13(2)18(9-15(12)11-30-17-6-4-16(24)5-7-17)21-19(10-25)22(26)29-23-20(21)14(3)27-28-23/h4-9,21H,11,26H2,1-3H3,(H,27,28)
InChIKey XLZAAPSGZWXJTQ-UHFFFAOYSA-N
NMR Offset 17.5268
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14370
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: UZI/1014951; UBI_ID: UBI-014373
Temperature 300 °C