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2-chloro-5-({[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetyl}amino)benzoic acid
SpectraBase Compound ID Arwul8ChlOc
InChI InChI=1S/C15H14ClN3O3S/c1-8-5-9(2)18-15(17-8)23-7-13(20)19-10-3-4-12(16)11(6-10)14(21)22/h3-6H,7H2,1-2H3,(H,19,20)(H,21,22)
InChIKey NRAPGZYTSKAUPI-UHFFFAOYSA-N
Mol Weight 351.81 g/mol
Molecular Formula C15H14ClN3O3S
Exact Mass 351.04444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dd0zBVyjOrn
Name 2-chloro-5-({[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetyl}amino)benzoic acid
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/C15H14ClN3O3S/c1-8-5-9(2)18-15(17-8)23-7-13(20)19-10-3-4-12(16)11(6-10)14(21)22/h3-6H,7H2,1-2H3,(H,19,20)(H,21,22)
InChIKey NRAPGZYTSKAUPI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35813
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: E94350; SBI_ID: SBI-035817
Temperature 308 °C