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N-(2-hydroxy-1,1-dimethylethyl)-2-methyl-5-{4-[4-(1-piperidinylcarbonyl)anilino]-1-phthalazinyl}benzenesulfonamide
SpectraBase Compound ID 7QsjhkVI7EU
InChI InChI=1S/C31H35N5O4S/c1-21-11-12-23(19-27(21)41(39,40)35-31(2,3)20-37)28-25-9-5-6-10-26(25)29(34-33-28)32-24-15-13-22(14-16-24)30(38)36-17-7-4-8-18-36/h5-6,9-16,19,35,37H,4,7-8,17-18,20H2,1-3H3,(H,32,34)
InChIKey KRXIJTYSMQZFGR-UHFFFAOYSA-N
Mol Weight 573.7 g/mol
Molecular Formula C31H35N5O4S
Exact Mass 573.240976 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HgSm549cXvi
Name N-(2-hydroxy-1,1-dimethylethyl)-2-methyl-5-{4-[4-(1-piperidinylcarbonyl)anilino]-1-phthalazinyl}benzenesulfonamide
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/C31H35N5O4S/c1-21-11-12-23(19-27(21)41(39,40)35-31(2,3)20-37)28-25-9-5-6-10-26(25)29(34-33-28)32-24-15-13-22(14-16-24)30(38)36-17-7-4-8-18-36/h5-6,9-16,19,35,37H,4,7-8,17-18,20H2,1-3H3,(H,32,34)
InChIKey KRXIJTYSMQZFGR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14981
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: C26510; Labnumber: RRAZ1-2387; SBI_ID: SBI-014984
Temperature 313 °C