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4(5H)-Thiazolone, 5-[(3,4-diethoxyphenyl)methylidene]-2-[4-(phenylmethyl)-1-piperazinyl]-
SpectraBase Compound ID FD7GnG99nC5
InChI InChI=1S/C25H29N3O3S/c1-3-30-21-11-10-20(16-22(21)31-4-2)17-23-24(29)26-25(32-23)28-14-12-27(13-15-28)18-19-8-6-5-7-9-19/h5-11,16-17H,3-4,12-15,18H2,1-2H3/b23-17+
InChIKey YTFSTYNVWFBUTK-HAVVHWLPSA-N
Mol Weight 451.59 g/mol
Molecular Formula C25H29N3O3S
Exact Mass 451.192963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6OJCU8XgZr5
Name 4(5H)-Thiazolone, 5-[(3,4-diethoxyphenyl)methylidene]-2-[4-(phenylmethyl)-1-piperazinyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29N3O3S
InChI InChI=1S/C25H29N3O3S/c1-3-30-21-11-10-20(16-22(21)31-4-2)17-23-24(29)26-25(32-23)28-14-12-27(13-15-28)18-19-8-6-5-7-9-19/h5-11,16-17H,3-4,12-15,18H2,1-2H3/b23-17+
InChIKey YTFSTYNVWFBUTK-HAVVHWLPSA-N
Molecular Weight 451.585 g/mol
SMILES c1ccc(CN2CCN(C3=NC(\C(=C/c4cc(OCC)c(cc4)OCC)S3)=O)CC2)cc1
SPLASH splash10-0007-7921000000-0dc56f911abc2f1c0018
Source of Spectrum IY-1-4484-7
Synonyms (5E)-5-[(3,4-diethoxyphenyl)methylidene]-2-[4-(phenylmethyl)-1-piperazinyl]-4-thiazolone (5E)-2-(4-benzylpiperazin-1-yl)-5-[(3,4-diethoxyphenyl)methylidene]-1,3-thiazol-4-one (5E)-2-(4-benzylpiperazin-1-yl)-5-[(3,4-diethoxyphenyl)methylene]thiazol-4-one (5E)-5-[(3,4-diethoxyphenyl)methylidene]-2-[4-(phenylmethyl)piperazin-1-yl]-1,3-thiazol-4-one
Wiley ID 1652830