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4-[({[4-({[amino(imino)methyl]amino}sulfonyl)anilino]carbothioyl}amino)carbonyl]-2-phenylquinoline
SpectraBase Compound ID LGmI7ASQmfk
InChI InChI=1S/C24H20N6O3S2/c25-23(26)30-35(32,33)17-12-10-16(11-13-17)27-24(34)29-22(31)19-14-21(15-6-2-1-3-7-15)28-20-9-5-4-8-18(19)20/h1-14H,(H4,25,26,30)(H2,27,29,31,34)
InChIKey LQCOSIPKEXCGEN-UHFFFAOYSA-N
Mol Weight 504.58 g/mol
Molecular Formula C24H20N6O3S2
Exact Mass 504.103831 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3uLjVyfqnOu
Name 4-[({[4-({[amino(imino)methyl]amino}sulfonyl)anilino]carbothioyl}amino)carbonyl]-2-phenylquinoline
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/C24H20N6O3S2/c25-23(26)30-35(32,33)17-12-10-16(11-13-17)27-24(34)29-22(31)19-14-21(15-6-2-1-3-7-15)28-20-9-5-4-8-18(19)20/h1-14H,(H4,25,26,30)(H2,27,29,31,34)
InChIKey LQCOSIPKEXCGEN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8221
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/1009203; UBI_ID: UBI-008224
Temperature 318 °C