2-(4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}phenoxy)acetamide

SpectraBase Compound ID	AKvoqZoibmD
InChI	InChI=1S/C27H29N5O5S/c1-17-8-9-18(14-23(17)38(35,36)32-27(2,3)16-33)25-21-6-4-5-7-22(21)26(31-30-25)29-19-10-12-20(13-11-19)37-15-24(28)34/h4-14,32-33H,15-16H2,1-3H3,(H2,28,34)(H,29,31)
InChIKey	CKBZWQJYYCPQFK-UHFFFAOYSA-N Google Search
Mol Weight	535.62 g/mol
Molecular Formula	C27H29N5O5S
Exact Mass	535.18894 g/mol

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SpectraBase Spectrum ID	EUQFADuDbmO
Name	2-(4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}phenoxy)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/C27H29N5O5S/c1-17-8-9-18(14-23(17)38(35,36)32-27(2,3)16-33)25-21-6-4-5-7-22(21)26(31-30-25)29-19-10-12-20(13-11-19)37-15-24(28)34/h4-14,32-33H,15-16H2,1-3H3,(H2,28,34)(H,29,31)
InChIKey	CKBZWQJYYCPQFK-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14983
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: C26512; Labnumber: RRAZ1-2389; SBI_ID: SBI-014986
Temperature	313 °C