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2-[(4-cyano-3-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-5-isothiazolyl)sulfanyl]-N-cyclopropylacetamide
SpectraBase Compound ID 2UkUJs9ABiy
InChI InChI=1S/C14H16N4O2S3/c15-5-10-13(21-6-11(19)16-8-1-2-8)18-23-14(10)22-7-12(20)17-9-3-4-9/h8-9H,1-4,6-7H2,(H,16,19)(H,17,20)
InChIKey DVCSZZKSYIWEAO-UHFFFAOYSA-N
Mol Weight 368.49 g/mol
Molecular Formula C14H16N4O2S3
Exact Mass 368.043539 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9dVuVYAXbUX
Name 2-[(4-cyano-3-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-5-isothiazolyl)sulfanyl]-N-cyclopropylacetamide
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/C14H16N4O2S3/c15-5-10-13(21-6-11(19)16-8-1-2-8)18-23-14(10)22-7-12(20)17-9-3-4-9/h8-9H,1-4,6-7H2,(H,16,19)(H,17,20)
InChIKey DVCSZZKSYIWEAO-UHFFFAOYSA-N
NMR Offset 16.4447
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_2993
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: TSH/5636731; IOH_ID: IOH-002994
Temperature 297 °C