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4-oxazolecarbonitrile, 2-[3-[(3,4-dihydro-2(1H)-isoquinolinyl)sulfonyl]-4-methoxyphenyl]-5-(dimethylamino)-
SpectraBase Compound ID G1foptCq70F
InChI InChI=1S/C22H22N4O4S/c1-25(2)22-18(13-23)24-21(30-22)16-8-9-19(29-3)20(12-16)31(27,28)26-11-10-15-6-4-5-7-17(15)14-26/h4-9,12H,10-11,14H2,1-3H3
InChIKey ATSPNISHVXGLPS-UHFFFAOYSA-N
Mol Weight 438.5 g/mol
Molecular Formula C22H22N4O4S
Exact Mass 438.136176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IDnOJyOft7
Name 4-oxazolecarbonitrile, 2-[3-[(3,4-dihydro-2(1H)-isoquinolinyl)sulfonyl]-4-methoxyphenyl]-5-(dimethylamino)-
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/C22H22N4O4S/c1-25(2)22-18(13-23)24-21(30-22)16-8-9-19(29-3)20(12-16)31(27,28)26-11-10-15-6-4-5-7-17(15)14-26/h4-9,12H,10-11,14H2,1-3H3
InChIKey ATSPNISHVXGLPS-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10443
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: F37763; Labnumber: TVIN-03915
Temperature 315 °C