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4-thiazolidinone, 3-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-(4-methoxyphenyl)-

View entire compound with spectra: 2 NMR

4-thiazolidinone, 3-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-(4-methoxyphenyl)-
SpectraBase Compound ID hvULS8DIc0
InChI InChI=1S/C21H21N3O3S/c1-14-19(20(26)24(22(14)2)16-7-5-4-6-8-16)23-18(25)13-28-21(23)15-9-11-17(27-3)12-10-15/h4-12,21H,13H2,1-3H3
InChIKey NZVDGSVUWGPNIF-UHFFFAOYSA-N
Mol Weight 395.48 g/mol
Molecular Formula C21H21N3O3S
Exact Mass 395.130363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3TREDg1GGO
Name 4-Thiazolidinone, 3-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-(4-methoxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.130362719 u
Formula C21H21N3O3S
InChI InChI=1S/C21H21N3O3S/c1-14-19(20(26)24(22(14)2)16-7-5-4-6-8-16)23-18(25)13-28-21(23)15-9-11-17(27-3)12-10-15/h4-12,21H,13H2,1-3H3
InChIKey NZVDGSVUWGPNIF-UHFFFAOYSA-N
Molecular Weight 395.477 g/mol
SMILES C=1(N2C(SCC2=O)C2=CC=C(C=C2)OC)C(N(C=2C=CC=CC2)N(C1C)C)=O