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4-[4-(acetylamino)phenyl]-N-(2-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
SpectraBase Compound ID HIL10O9UAg8
InChI InChI=1S/C20H19ClN4O2S/c1-11-17(19(27)24-16-6-4-3-5-15(16)21)18(25-20(28)22-11)13-7-9-14(10-8-13)23-12(2)26/h3-10,18H,1-2H3,(H,23,26)(H,24,27)(H2,22,25,28)
InChIKey KVLBPIDAWDSAKE-UHFFFAOYSA-N
Mol Weight 414.91 g/mol
Molecular Formula C20H19ClN4O2S
Exact Mass 414.091725 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BMB7wGlChaq
Name 4-[4-(acetylamino)phenyl]-N-(2-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
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/C20H19ClN4O2S/c1-11-17(19(27)24-16-6-4-3-5-15(16)21)18(25-20(28)22-11)13-7-9-14(10-8-13)23-12(2)26/h3-10,18H,1-2H3,(H,23,26)(H,24,27)(H2,22,25,28)
InChIKey KVLBPIDAWDSAKE-UHFFFAOYSA-N
NMR Offset 17.9121
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_30766
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: 1726451; SBI_ID: SBI-030770
Temperature 303 °C