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3'-Butyl-5-(5-methoxy-3-methyl-3H-benzothiazol-2-ylidene)-3-methyl-2'-thioxo-[2,5']bithiazolidinylidene-4,4'-dione
SpectraBase Compound ID waJqB0oezY
InChI InChI=1S/C20H21N3O3S4/c1-5-6-9-23-17(25)15(30-20(23)27)19-22(3)16(24)14(29-19)18-21(2)12-10-11(26-4)7-8-13(12)28-18/h7-8,10H,5-6,9H2,1-4H3/b18-14-,19-15+
InChIKey UCXVSZGQQHXREB-KPNKYRRCSA-N
Mol Weight 479.6 g/mol
Molecular Formula C20H21N3O3S4
Exact Mass 479.046576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJgAcqALAyM
Name 3'-Butyl-5-(5-methoxy-3-methyl-3H-benzothiazol-2-ylidene)-3-methyl-2'-thioxo-[2,5']bithiazolidinylidene-4,4'-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O3S4
InChI InChI=1S/C20H21N3O3S4/c1-5-6-9-23-17(25)15(30-20(23)27)19-22(3)16(24)14(29-19)18-21(2)12-10-11(26-4)7-8-13(12)28-18/h7-8,10H,5-6,9H2,1-4H3/b18-14-,19-15+
InChIKey UCXVSZGQQHXREB-KPNKYRRCSA-N
Molecular Weight 479.646 g/mol
SMILES c12S\C(N(c1cc(cc2)OC)C)=C\1C(N(\C(S1)=C\1SC(N(C1=O)CCCC)=S)C)=O
SPLASH splash10-00du-9542000000-5e41e332e69fd194dd1d
Synonyms 2-[(5E)-3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-5-[(2Z)-5-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-3-methyl-1,3-thiazolidin-4-one
Wiley ID 1438526