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4-oxazolecarbonitrile, 2-[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-5-[(3-pyridinylmethyl)amino]-
SpectraBase Compound ID 67JacNrhGzU
InChI InChI=1S/C21H21N5O4S/c1-29-18-7-6-16(11-19(18)31(27,28)26-9-2-3-10-26)20-25-17(12-22)21(30-20)24-14-15-5-4-8-23-13-15/h4-8,11,13,24H,2-3,9-10,14H2,1H3
InChIKey DISXVOCTMRNLJD-UHFFFAOYSA-N
Mol Weight 439.49 g/mol
Molecular Formula C21H21N5O4S
Exact Mass 439.131425 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GM4oZHhlJQE
Name 4-oxazolecarbonitrile, 2-[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-5-[(3-pyridinylmethyl)amino]-
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/C21H21N5O4S/c1-29-18-7-6-16(11-19(18)31(27,28)26-9-2-3-10-26)20-25-17(12-22)21(30-20)24-14-15-5-4-8-23-13-15/h4-8,11,13,24H,2-3,9-10,14H2,1H3
InChIKey DISXVOCTMRNLJD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10429
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: F37748; Labnumber: TVIN-03727
Temperature 315 °C