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ethyl 2-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID EW3lUFf09Ts
InChI InChI=1S/C19H24N4O5S/c1-4-28-19(25)16-13-8-6-5-7-9-14(13)29-18(16)20-15(24)10-22-12(3)17(23(26)27)11(2)21-22/h4-10H2,1-3H3,(H,20,24)
InChIKey RVSLEZLFMSLKDB-UHFFFAOYSA-N
Mol Weight 420.48 g/mol
Molecular Formula C19H24N4O5S
Exact Mass 420.146741 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H2KfROzSWQD
Name ethyl 2-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-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/C19H24N4O5S/c1-4-28-19(25)16-13-8-6-5-7-9-14(13)29-18(16)20-15(24)10-22-12(3)17(23(26)27)11(2)21-22/h4-10H2,1-3H3,(H,20,24)
InChIKey RVSLEZLFMSLKDB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9555
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/8072906; Labnumber: IDV-0004312; UZI_ID: UZI-009557
Temperature 308 °C