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[N(1)-tert-Butyl-N(1)-(5-phenylthiazolo[2,3-b]-1,3,4-thiazol-4-iumyl)amino]-N(2)-cytert-butylamino-[N(3)-[4-pheny-2-thioxothiazol-3-yl]imino]methane

View entire compound with spectra: 1 MS (GC)

[N(1)-tert-Butyl-N(1)-(5-phenylthiazolo[2,3-b]-1,3,4-thiazol-4-iumyl)amino]-N(2)-cytert-butylamino-[N(3)-[4-pheny-2-thioxothiazol-3-yl]imino]methane
SpectraBase Compound ID JvpBhXFM5rF
InChI InChI=1S/C28H30N6S4/c1-5-6-17-29-24(30-33-22(18-36-26(33)35)20-13-9-7-10-14-20)32(28(2,3)4)25-31-34-23(19-37-27(34)38-25)21-15-11-8-12-16-21/h7-16,18-19H,5-6,17H2,1-4H3
InChIKey OHUMPLJBOKNJPT-UHFFFAOYSA-N
Mol Weight 578.8 g/mol
Molecular Formula C28H30N6S4
Exact Mass 578.14148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BbS9lbl8zB
Name [N(1)-tert-Butyl-N(1)-(5-phenylthiazolo[2,3-b]-1,3,4-thiazol-4-iumyl)amino]-N(2)-cytert-butylamino-[N(3)-[4-pheny-2-thioxothiazol-3-yl]imino]methane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N6S4
InChI InChI=1S/C28H30N6S4/c1-5-6-17-29-24(30-33-22(18-36-26(33)35)20-13-9-7-10-14-20)32(28(2,3)4)25-31-34-23(19-37-27(34)38-25)21-15-11-8-12-16-21/h7-16,18-19H,5-6,17H2,1-4H3
InChIKey OHUMPLJBOKNJPT-UHFFFAOYSA-N
Molecular Weight 578.830 g/mol
SMILES c1(n[n+]2c(s1)scc2-c1ccccc1)N(\C(=N\N1C(=CSC1=S)c1ccccc1)[N-]CCCC)C(C)(C)C
SPLASH splash10-001i-1930000000-86ccea710477b837b48d
Source of Spectrum F-48-1293-5
Synonyms 2-{tert-butyl[(1E)-(butylazanidyl)[N'-(4-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl)imino]methyl]amino}-6-phenyl-3,4,1,7000000-[1,3]thiazolo[2,3-b][1,3,4]thiadiazol-7-ylium
Wiley ID 1408329