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4-pyrimidinecarboxamide, 5-chloro-N-(3-chlorophenyl)-2-[[(3-methylphenyl)methyl]thio]-
SpectraBase Compound ID EHt3dXpCar2
InChI InChI=1S/C19H15Cl2N3OS/c1-12-4-2-5-13(8-12)11-26-19-22-10-16(21)17(24-19)18(25)23-15-7-3-6-14(20)9-15/h2-10H,11H2,1H3,(H,23,25)
InChIKey CPKRJRHPTCTGEQ-UHFFFAOYSA-N
Mol Weight 404.32 g/mol
Molecular Formula C19H15Cl2N3OS
Exact Mass 403.031289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LXYvnfh5kBj
Name 4-pyrimidinecarboxamide, 5-chloro-N-(3-chlorophenyl)-2-[[(3-methylphenyl)methyl]thio]-
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/C19H15Cl2N3OS/c1-12-4-2-5-13(8-12)11-26-19-22-10-16(21)17(24-19)18(25)23-15-7-3-6-14(20)9-15/h2-10H,11H2,1H3,(H,23,25)
InChIKey CPKRJRHPTCTGEQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3
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: F01912; Labnumber: BROV-S1139-0390