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2-(4-{[4-(4-methyl-3-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}phenyl)acetamide
SpectraBase Compound ID GKxU80TFbZu
InChI InChI=1S/C28H29N5O4S/c1-18-8-11-20(16-25(18)38(35,36)30-17-22-5-4-14-37-22)27-23-6-2-3-7-24(23)28(33-32-27)31-21-12-9-19(10-13-21)15-26(29)34/h2-3,6-13,16,22,30H,4-5,14-15,17H2,1H3,(H2,29,34)(H,31,33)
InChIKey NCGKYMQMCVUZEC-UHFFFAOYSA-N
Mol Weight 531.63 g/mol
Molecular Formula C28H29N5O4S
Exact Mass 531.194026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CZalJFsoMl0
Name 2-(4-{[4-(4-methyl-3-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)-1-phthalazinyl]amino}phenyl)acetamide
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/C28H29N5O4S/c1-18-8-11-20(16-25(18)38(35,36)30-17-22-5-4-14-37-22)27-23-6-2-3-7-24(23)28(33-32-27)31-21-12-9-19(10-13-21)15-26(29)34/h2-3,6-13,16,22,30H,4-5,14-15,17H2,1H3,(H2,29,34)(H,31,33)
InChIKey NCGKYMQMCVUZEC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15018
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: C26558; Labnumber: RRAZ1-2491; SBI_ID: SBI-015021
Temperature 313 °C