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methyl 2-[(3,4-dihydro-2(1H)-isoquinolinylcarbothioyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylate
SpectraBase Compound ID 3duA1zOKfG2
InChI InChI=1S/C23H22N2O2S2/c1-15-19(17-9-4-3-5-10-17)20(22(26)27-2)21(29-15)24-23(28)25-13-12-16-8-6-7-11-18(16)14-25/h3-11H,12-14H2,1-2H3,(H,24,28)
InChIKey YCJBEXQTHMTFPA-UHFFFAOYSA-N
Mol Weight 422.56 g/mol
Molecular Formula C23H22N2O2S2
Exact Mass 422.11227 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2ZNIKmFcGgv
Name methyl 2-[(3,4-dihydro-2(1H)-isoquinolinylcarbothioyl)amino]-5-methyl-4-phenyl-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/C23H22N2O2S2/c1-15-19(17-9-4-3-5-10-17)20(22(26)27-2)21(29-15)24-23(28)25-13-12-16-8-6-7-11-18(16)14-25/h3-11H,12-14H2,1-2H3,(H,24,28)
InChIKey YCJBEXQTHMTFPA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7589
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/1269086; Labnumber: COL5496; UZI_ID: UZI-007591
Temperature 318 °C