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ethyl 2-[(3-{[(4-chlorophenyl)sulfonyl]amino}propanoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID Gip5HVvHr5o
InChI InChI=1S/C18H21ClN2O5S2/c1-4-26-18(23)16-11(2)12(3)27-17(16)21-15(22)9-10-20-28(24,25)14-7-5-13(19)6-8-14/h5-8,20H,4,9-10H2,1-3H3,(H,21,22)
InChIKey PTUXWFAUDXVWBH-UHFFFAOYSA-N
Mol Weight 444.95 g/mol
Molecular Formula C18H21ClN2O5S2
Exact Mass 444.058042 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BY1SZ9mT24F
Name ethyl 2-[(3-{[(4-chlorophenyl)sulfonyl]amino}propanoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
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/C18H21ClN2O5S2/c1-4-26-18(23)16-11(2)12(3)27-17(16)21-15(22)9-10-20-28(24,25)14-7-5-13(19)6-8-14/h5-8,20H,4,9-10H2,1-3H3,(H,21,22)
InChIKey PTUXWFAUDXVWBH-UHFFFAOYSA-N
NMR Offset 14.7616
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_ASIOH_7000_3555
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: ZI/7085379; Labnumber: DS-0000734; IOH_ID: IOH-003556
Temperature 297 °C