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3-[(2'-Iodoacetyl)amino]-5-[(2'-methyl-3'-phenyl)propenylidene]-2-thioxothiazolidin-4-one
SpectraBase Compound ID HE6CREBCEcz
InChI InChI=1S/C15H13IN2O2S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(20)18(15(21)22-12)17-13(19)9-16/h2-6H,7,9H2,1H3,(H,17,19)
InChIKey XNLBKHAZTRGFLP-UHFFFAOYSA-N
Mol Weight 444.31 g/mol
Molecular Formula C15H13IN2O2S2
Exact Mass 443.946315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ogf3i5kVQT
Name 3-[(2'-Iodoacetyl)amino]-5-[(2'-methyl-3'-phenyl)propenylidene]-2-thioxothiazolidin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H13IN2O2S2
InChI InChI=1S/C15H13IN2O2S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(20)18(15(21)22-12)17-13(19)9-16/h2-6H,7,9H2,1H3,(H,17,19)
InChIKey XNLBKHAZTRGFLP-UHFFFAOYSA-N
Molecular Weight 444.305 g/mol
SMILES N(N1C(C(=C=C(Cc2ccccc2)C)SC1=S)=O)C(=O)CI
SPLASH splash10-0006-0900000000-1a2859d81337dd1da678
Source of Spectrum Y-32-1024-3
Synonyms 2-iodo-N-[5-(2-methyl-3-phenyl-1-propenylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Wiley ID 1385848