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methyl 2-{[(3-chloro-6-fluoro-1-benzothien-2-yl)carbonyl]amino}-5-propyl-3-thiophenecarboxylate
SpectraBase Compound ID 79M3rbHnOPf
InChI InChI=1S/C18H15ClFNO3S2/c1-3-4-10-8-12(18(23)24-2)17(25-10)21-16(22)15-14(19)11-6-5-9(20)7-13(11)26-15/h5-8H,3-4H2,1-2H3,(H,21,22)
InChIKey NKXNITZFTQQYLC-UHFFFAOYSA-N
Mol Weight 411.89 g/mol
Molecular Formula C18H15ClFNO3S2
Exact Mass 411.016592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DsqSgFOW4L3
Name methyl 2-{[(3-chloro-6-fluoro-1-benzothien-2-yl)carbonyl]amino}-5-propyl-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/C18H15ClFNO3S2/c1-3-4-10-8-12(18(23)24-2)17(25-10)21-16(22)15-14(19)11-6-5-9(20)7-13(11)26-15/h5-8H,3-4H2,1-2H3,(H,21,22)
InChIKey NKXNITZFTQQYLC-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11775
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/9099752; UBI_ID: UBI-011778
Temperature 313 °C