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methyl 2-{[(4-methyl-1-piperazinyl)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID DHhU8U1aLyg
InChI InChI=1S/C16H23N3O2S2/c1-18-7-9-19(10-8-18)16(22)17-14-13(15(20)21-2)11-5-3-4-6-12(11)23-14/h3-10H2,1-2H3,(H,17,22)
InChIKey KYBMRRWNJVYGSX-UHFFFAOYSA-N
Mol Weight 353.5 g/mol
Molecular Formula C16H23N3O2S2
Exact Mass 353.123169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 85AIAVmivli
Name methyl 2-{[(4-methyl-1-piperazinyl)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/C16H23N3O2S2/c1-18-7-9-19(10-8-18)16(22)17-14-13(15(20)21-2)11-5-3-4-6-12(11)23-14/h3-10H2,1-2H3,(H,17,22)
InChIKey KYBMRRWNJVYGSX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7829
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/1268994; Labnumber: COL6197; UZI_ID: UZI-007831
Temperature 318 °C