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3-(4-Methyl-1-piperidinyl)-1-[4-(4-morpholinylsulfonyl)phenyl]-2,5-pyrrolidinedione

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3-(4-Methyl-1-piperidinyl)-1-[4-(4-morpholinylsulfonyl)phenyl]-2,5-pyrrolidinedione
SpectraBase Compound ID CqCm5wH0iWd
InChI InChI=1S/C20H27N3O5S/c1-15-6-8-21(9-7-15)18-14-19(24)23(20(18)25)16-2-4-17(5-3-16)29(26,27)22-10-12-28-13-11-22/h2-5,15,18H,6-14H2,1H3
InChIKey LITMOHOBEYXEOL-UHFFFAOYSA-N
Mol Weight 421.51 g/mol
Molecular Formula C20H27N3O5S
Exact Mass 421.167142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lp19bgNcE3r
Name 3-(4-Methyl-1-piperidinyl)-1-[4-(4-morpholinylsulfonyl)phenyl]-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.167142150 u
Formula C20H27N3O5S
InChI InChI=1S/C20H27N3O5S/c1-15-6-8-21(9-7-15)18-14-19(24)23(20(18)25)16-2-4-17(5-3-16)29(26,27)22-10-12-28-13-11-22/h2-5,15,18H,6-14H2,1H3
InChIKey LITMOHOBEYXEOL-UHFFFAOYSA-N
Molecular Weight 421.512 g/mol
SMILES CC1CCN(C2C(N(C3=CC=C(S(N4CCOCC4)(=O)=O)C=C3)C(C2)=O)=O)CC1