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N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide

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N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide
SpectraBase Compound ID BusK1bfZSIp
InChI InChI=1S/C20H19N3O3S/c1-2-26-15-9-7-14(8-10-15)23-12-13(11-18(23)24)19(25)22-20-21-16-5-3-4-6-17(16)27-20/h3-10,13H,2,11-12H2,1H3,(H,21,22,25)
InChIKey ZDFKSHUFJAEHDI-UHFFFAOYSA-N
Mol Weight 381.45 g/mol
Molecular Formula C20H19N3O3S
Exact Mass 381.114713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfVfEezgoDW
Name N-(1,3-Benzothiazol-2-yl)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.114712655 u
Formula C20H19N3O3S
InChI InChI=1S/C20H19N3O3S/c1-2-26-15-9-7-14(8-10-15)23-12-13(11-18(23)24)19(25)22-20-21-16-5-3-4-6-17(16)27-20/h3-10,13H,2,11-12H2,1H3,(H,21,22,25)
InChIKey ZDFKSHUFJAEHDI-UHFFFAOYSA-N
Molecular Weight 381.450 g/mol
SMILES N(C1=NC=2C=CC=CC2S1)C(C1CN(C=2C=CC(=CC2)OCC)C(C1)=O)=O