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6-amino-3-{[(4-methylphenyl)sulfanyl]methyl}-4-(4-pyridinyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID 7jaw1IZWP77
InChI InChI=1S/C20H17N5OS/c1-12-2-4-14(5-3-12)27-11-16-18-17(13-6-8-23-9-7-13)15(10-21)19(22)26-20(18)25-24-16/h2-9,17H,11,22H2,1H3,(H,24,25)
InChIKey ZBGXVNSALFCOBN-UHFFFAOYSA-N
Mol Weight 375.45 g/mol
Molecular Formula C20H17N5OS
Exact Mass 375.115381 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ABbjKSJz9gY
Name 6-amino-3-{[(4-methylphenyl)sulfanyl]methyl}-4-(4-pyridinyl)-2,4-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/C20H17N5OS/c1-12-2-4-14(5-3-12)27-11-16-18-17(13-6-8-23-9-7-13)15(10-21)19(22)26-20(18)25-24-16/h2-9,17H,11,22H2,1H3,(H,24,25)
InChIKey ZBGXVNSALFCOBN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10475
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: 132549; Labnumber: SHES1-100; VK_ID: VK-010479
Temperature 308 °C