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(5Z)-5-{[5-(2,4-dichlorophenyl)-2-furyl]methylene}-2-[4-(3-methylphenyl)-1-piperazinyl]-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 6S8sMexJccj
InChI InChI=1S/C25H21Cl2N3O2S/c1-16-3-2-4-18(13-16)29-9-11-30(12-10-29)25-28-24(31)23(33-25)15-19-6-8-22(32-19)20-7-5-17(26)14-21(20)27/h2-8,13-15H,9-12H2,1H3/b23-15-
InChIKey MEOKCRRLKQRNLN-HAHDFKILSA-N
Mol Weight 498.43 g/mol
Molecular Formula C25H21Cl2N3O2S
Exact Mass 497.073154 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NsYBhwfDRm
Name (5Z)-5-{[5-(2,4-Dichlorophenyl)-2-furyl]methylene}-2-[4-(3-methylphenyl)-1-piperazinyl]-1,3-thiazol-4(5H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 497.073153500 u
Formula C25H21Cl2N3O2S
InChI InChI=1S/C25H21Cl2N3O2S/c1-16-3-2-4-18(13-16)29-9-11-30(12-10-29)25-28-24(31)23(33-25)15-19-6-8-22(32-19)20-7-5-17(26)14-21(20)27/h2-8,13-15H,9-12H2,1H3/b23-15-
InChIKey MEOKCRRLKQRNLN-HAHDFKILSA-N
Molecular Weight 498.428 g/mol
SMILES CC=1C=C(N2CCN(C3=NC(\C(=C\C=4OC(C=5C(=CC(=CC5)Cl)Cl)=CC4)S3)=O)CC2)C=CC1