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2-Thiophenecarboxylic acid, 3-[[1,2-dioxo-2-[[3-(2-oxo-1-pyrrolidinyl)propyl]amino]ethyl]amino]-, methyl ester

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2-Thiophenecarboxylic acid, 3-[[1,2-dioxo-2-[[3-(2-oxo-1-pyrrolidinyl)propyl]amino]ethyl]amino]-, methyl ester
SpectraBase Compound ID 8Pkh4axCgMO
InChI InChI=1S/C15H19N3O5S/c1-23-15(22)12-10(5-9-24-12)17-14(21)13(20)16-6-3-8-18-7-2-4-11(18)19/h5,9H,2-4,6-8H2,1H3,(H,16,20)(H,17,21)
InChIKey NEYAZBMSSHEFJG-UHFFFAOYSA-N
Mol Weight 353.39 g/mol
Molecular Formula C15H19N3O5S
Exact Mass 353.104542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BKtt3b50MpB
Name 2-Thiophenecarboxylic acid, 3-[[1,2-dioxo-2-[[3-(2-oxo-1-pyrrolidinyl)propyl]amino]ethyl]amino]-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.104541893 u
Formula C15H19N3O5S
InChI InChI=1S/C15H19N3O5S/c1-23-15(22)12-10(5-9-24-12)17-14(21)13(20)16-6-3-8-18-7-2-4-11(18)19/h5,9H,2-4,6-8H2,1H3,(H,16,20)(H,17,21)
InChIKey NEYAZBMSSHEFJG-UHFFFAOYSA-N
Molecular Weight 353.393 g/mol
SMILES N(C(C(=O)NCCCN1C(=O)CCC1)=O)C1=C(C(=O)OC)SC=C1