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ethyl 2-({[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID I1b7Xk8uWq3
InChI InChI=1S/C22H24N2O4S3/c1-3-27-13-9-10-15-17(11-13)31-22(23-15)29-12-18(25)24-20-19(21(26)28-4-2)14-7-5-6-8-16(14)30-20/h9-11H,3-8,12H2,1-2H3,(H,24,25)
InChIKey BCWDBJQONVLACI-UHFFFAOYSA-N
Mol Weight 476.62 g/mol
Molecular Formula C22H24N2O4S3
Exact Mass 476.089821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2xJ0pyhApK
Name ethyl 2-({[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C22H24N2O4S3/c1-3-27-13-9-10-15-17(11-13)31-22(23-15)29-12-18(25)24-20-19(21(26)28-4-2)14-7-5-6-8-16(14)30-20/h9-11H,3-8,12H2,1-2H3,(H,24,25)
InChIKey BCWDBJQONVLACI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18224
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/8096628; Labnumber: TQ-0224; UZI_ID: UZI-018231
Temperature 313 °C