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2-methoxy-N-methyl-5-{[4-(4-methyl-3-{[(1-phenylethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}benzamide
SpectraBase Compound ID HoIODEIko1g
InChI InChI=1S/C32H31N5O4S/c1-20-14-15-23(18-29(20)42(39,40)37-21(2)22-10-6-5-7-11-22)30-25-12-8-9-13-26(25)31(36-35-30)34-24-16-17-28(41-4)27(19-24)32(38)33-3/h5-19,21,37H,1-4H3,(H,33,38)(H,34,36)
InChIKey RYMVZTJFNCIDCS-UHFFFAOYSA-N
Mol Weight 581.7 g/mol
Molecular Formula C32H31N5O4S
Exact Mass 581.209676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 17CbQhY3EiC
Name 2-methoxy-N-methyl-5-{[4-(4-methyl-3-{[(1-phenylethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}benzamide
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/C32H31N5O4S/c1-20-14-15-23(18-29(20)42(39,40)37-21(2)22-10-6-5-7-11-22)30-25-12-8-9-13-26(25)31(36-35-30)34-24-16-17-28(41-4)27(19-24)32(38)33-3/h5-19,21,37H,1-4H3,(H,33,38)(H,34,36)
InChIKey RYMVZTJFNCIDCS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15000
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: C26531; Labnumber: RRAZ1-2411; SBI_ID: SBI-015003
Temperature 313 °C