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(5E)-2-(4-benzhydrylpiperazin-1-yl)-5-[(2,5-dimethoxyphenyl)methylene]thiazol-4-one
SpectraBase Compound ID GdPbdGw0iIm
InChI InChI=1S/C29H29N3O3S/c1-34-24-13-14-25(35-2)23(19-24)20-26-28(33)30-29(36-26)32-17-15-31(16-18-32)27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19-20,27H,15-18H2,1-2H3/b26-20+
InChIKey NKIPXJWEFVEOOG-LHLOQNFPSA-N
Mol Weight 499.63 g/mol
Molecular Formula C29H29N3O3S
Exact Mass 499.192963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F86ty3lWk61
Name (5E)-2-(4-benzhydrylpiperazin-1-yl)-5-[(2,5-dimethoxyphenyl)methylene]thiazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H29N3O3S
InChI InChI=1S/C29H29N3O3S/c1-34-24-13-14-25(35-2)23(19-24)20-26-28(33)30-29(36-26)32-17-15-31(16-18-32)27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19-20,27H,15-18H2,1-2H3/b26-20+
InChIKey NKIPXJWEFVEOOG-LHLOQNFPSA-N
Molecular Weight 499.629 g/mol
SMILES c1ccc(C(N2CCN(C3=NC(\C(=C/c4c(ccc(c4)OC)OC)S3)=O)CC2)c2ccccc2)cc1
SPLASH splash10-014l-4910000000-c58ec62560a7ed554439
Synonyms (5E)-2-(4-benzhydrylpiperazin-1-yl)-5-[(2,5-dimethoxyphenyl)methylidene]-1,3-thiazol-4-one (5E)-2-(4-benzhydrylpiperazino)-5-(2,5-dimethoxybenzylidene)-2-thiazolin-4-one (5E)-5-[(2,5-dimethoxyphenyl)methylidene]-2-[4-(diphenylmethyl)-1-piperazinyl]-4-thiazolone (5E)-5-[(2,5-dimethoxyphenyl)methylidene]-2-[4-(diphenylmethyl)piperazin-1-yl]-1,3-thiazol-4-one
Wiley ID 1455253