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N-{2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}(phenyl)methanesulfonamide

View entire compound with spectra: 2 NMR

N-{2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}(phenyl)methanesulfonamide
SpectraBase Compound ID KS71kiasnrw
InChI InChI=1S/C27H28N2O6S/c1-32-24-13-19-10-11-28-23(21(19)15-26(24)34-3)12-20-14-25(33-2)27(35-4)16-22(20)29-36(30,31)17-18-8-6-5-7-9-18/h5-11,13-16,29H,12,17H2,1-4H3
InChIKey LKDDZHYUGZNMGN-UHFFFAOYSA-N
Mol Weight 508.59 g/mol
Molecular Formula C27H28N2O6S
Exact Mass 508.166808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9C1BabEmFp4
Name N-{2-[(6,7-Dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}(phenyl)methanesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.166807798 u
Formula C27H28N2O6S
InChI InChI=1S/C27H28N2O6S/c1-32-24-13-19-10-11-28-23(21(19)15-26(24)34-3)12-20-14-25(33-2)27(35-4)16-22(20)29-36(30,31)17-18-8-6-5-7-9-18/h5-11,13-16,29H,12,17H2,1-4H3
InChIKey LKDDZHYUGZNMGN-UHFFFAOYSA-N
Molecular Weight 508.589 g/mol
SMILES N(S(=O)(=O)CC1=CC=CC=C1)C=1C(CC=2C=3C=C(OC)C(=CC3C=CN2)OC)=CC(=C(C1)OC)OC