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ethyl 2-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID 2C7YWNXfsk2
InChI InChI=1S/C18H16ClNO3S2/c1-4-23-18(22)13-9(2)10(3)24-17(13)20-16(21)15-14(19)11-7-5-6-8-12(11)25-15/h5-8H,4H2,1-3H3,(H,20,21)
InChIKey GLUKTLWCQCAZMY-UHFFFAOYSA-N
Mol Weight 393.9 g/mol
Molecular Formula C18H16ClNO3S2
Exact Mass 393.026013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9m6pCpqnZ3Z
Name ethyl 2-{[(3-chloro-1-benzothien-2-yl)carbonyl]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/C18H16ClNO3S2/c1-4-23-18(22)13-9(2)10(3)24-17(13)20-16(21)15-14(19)11-7-5-6-8-12(11)25-15/h5-8H,4H2,1-3H3,(H,20,21)
InChIKey GLUKTLWCQCAZMY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_568
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/6156480; UBI_ID: UBI-000569
Temperature 308 °C