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2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide

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2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide
SpectraBase Compound ID LH6rJ6l6Ku2
InChI InChI=1S/C16H16BrN5O3S/c1-8-3-4-10-11(6-18)16(26-12(10)5-8)19-13(23)7-21-9(2)14(17)15(20-21)22(24)25/h8H,3-5,7H2,1-2H3,(H,19,23)
InChIKey UYQFLKQMJMBQGN-UHFFFAOYSA-N
Mol Weight 438.3 g/mol
Molecular Formula C16H16BrN5O3S
Exact Mass 437.015724 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Xs22aXPVI9
Name 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide
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/C16H16BrN5O3S/c1-8-3-4-10-11(6-18)16(26-12(10)5-8)19-13(23)7-21-9(2)14(17)15(20-21)22(24)25/h8H,3-5,7H2,1-2H3,(H,19,23)
InChIKey UYQFLKQMJMBQGN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9554
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/8088547; Labnumber: IDV-0004272; UZI_ID: UZI-009556
Temperature 318 °C