For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

benzo[b]thiophene-3-carboxamide, 2-[[(2E)-2-cyano-3-[4-(dimethylamino)phenyl]-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro-

View entire compound with spectra: 1 NMR

benzo[b]thiophene-3-carboxamide, 2-[[(2E)-2-cyano-3-[4-(dimethylamino)phenyl]-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro-
SpectraBase Compound ID KDJ3cFElpQA
InChI InChI=1S/C21H22N4O2S/c1-25(2)15-9-7-13(8-10-15)11-14(12-22)20(27)24-21-18(19(23)26)16-5-3-4-6-17(16)28-21/h7-11H,3-6H2,1-2H3,(H2,23,26)(H,24,27)/b14-11+
InChIKey ZRBQTWCLYKHVFR-SDNWHVSQSA-N
Mol Weight 394.49 g/mol
Molecular Formula C21H22N4O2S
Exact Mass 394.146347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6S25pgdixxz
Name benzo[b]thiophene-3-carboxamide, 2-[[(2E)-2-cyano-3-[4-(dimethylamino)phenyl]-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.146347136 u
Formula C21H22N4O2S
InChI InChI=1S/C21H22N4O2S/c1-25(2)15-9-7-13(8-10-15)11-14(12-22)20(27)24-21-18(19(23)26)16-5-3-4-6-17(16)28-21/h7-11H,3-6H2,1-2H3,(H2,23,26)(H,24,27)/b14-11+
InChIKey ZRBQTWCLYKHVFR-SDNWHVSQSA-N
Molecular Weight 394.493 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11998
Solvent DMSO-d6
Source Vendor ID: ZI/10026652; Lab Info: OBU; Lab Number: obu6a-0000326