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N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(2-iodobenzoyl)amino]carbothioyl}amino)benzenesulfonamide
SpectraBase Compound ID 71jnzHu4P0F
InChI InChI=1S/C20H18IN5O5S2/c1-30-17-11-16(23-19(24-17)31-2)26-33(28,29)13-9-7-12(8-10-13)22-20(32)25-18(27)14-5-3-4-6-15(14)21/h3-11H,1-2H3,(H,23,24,26)(H2,22,25,27,32)
InChIKey YZRQZTKLZOBQOM-UHFFFAOYSA-N
Mol Weight 599.42 g/mol
Molecular Formula C20H18IN5O5S2
Exact Mass 598.979406 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1tO1Tx7l0nA
Name N-(2,6-dimethoxy-4-pyrimidinyl)-4-({[(2-iodobenzoyl)amino]carbothioyl}amino)benzenesulfonamide
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/C20H18IN5O5S2/c1-30-17-11-16(23-19(24-17)31-2)26-33(28,29)13-9-7-12(8-10-13)22-20(32)25-18(27)14-5-3-4-6-15(14)21/h3-11H,1-2H3,(H,23,24,26)(H2,22,25,27,32)
InChIKey YZRQZTKLZOBQOM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9583
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/9052334; UBI_ID: UBI-009586
Temperature 308 °C