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methyl {4-[({[4-(aminosulfonyl)benzyl]amino}carbothioyl)amino]phenyl}acetate
SpectraBase Compound ID 2MQleEQqrk
InChI InChI=1S/C17H19N3O4S2/c1-24-16(21)10-12-2-6-14(7-3-12)20-17(25)19-11-13-4-8-15(9-5-13)26(18,22)23/h2-9H,10-11H2,1H3,(H2,18,22,23)(H2,19,20,25)
InChIKey UNGBVOKKKSEVNX-UHFFFAOYSA-N
Mol Weight 393.48 g/mol
Molecular Formula C17H19N3O4S2
Exact Mass 393.081698 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzXvYQVeBOK
Name methyl {4-[({[4-(aminosulfonyl)benzyl]amino}carbothioyl)amino]phenyl}acetate
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/C17H19N3O4S2/c1-24-16(21)10-12-2-6-14(7-3-12)20-17(25)19-11-13-4-8-15(9-5-13)26(18,22)23/h2-9H,10-11H2,1H3,(H2,18,22,23)(H2,19,20,25)
InChIKey UNGBVOKKKSEVNX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11642
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: E09167; Labnumber: VGU-21283; SBI_ID: SBI-011645
Temperature 318 °C