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ethyl 6-ethyl-2-[({[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}carbothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 9wFqCbprwlZ
InChI InChI=1S/C19H24N4O3S2/c1-4-11-6-7-12-14(10-11)28-17(15(12)18(25)26-5-2)22-19(27)21-16(24)13-8-9-20-23(13)3/h8-9,11H,4-7,10H2,1-3H3,(H2,21,22,24,27)
InChIKey LLQUVORSLAKQQV-UHFFFAOYSA-N
Mol Weight 420.55 g/mol
Molecular Formula C19H24N4O3S2
Exact Mass 420.128983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FwOoLY2tGat
Name ethyl 6-ethyl-2-[({[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}carbothioyl)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/C19H24N4O3S2/c1-4-11-6-7-12-14(10-11)28-17(15(12)18(25)26-5-2)22-19(27)21-16(24)13-8-9-20-23(13)3/h8-9,11H,4-7,10H2,1-3H3,(H2,21,22,24,27)
InChIKey LLQUVORSLAKQQV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_944
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/1007684; UBI_ID: UBI-000945
Temperature 318 °C