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3-[2'-Methoxycarbonylpropionyl)amino]-5-[2'-methyl-3'-phenylpropenylidene]-2-thioxothiazolidin-4-one
SpectraBase Compound ID HEjrLNdfrJ7
InChI InChI=1S/C18H18N2O4S2/c1-11(9-13-7-5-4-6-8-13)10-14-16(22)20(18(25)26-14)19-15(21)12(2)17(23)24-3/h4-10,12H,1-3H3,(H,19,21)/b11-9+,14-10-
InChIKey AODOFXNOBVKWDU-VDVFTDKOSA-N
Mol Weight 390.47 g/mol
Molecular Formula C18H18N2O4S2
Exact Mass 390.070799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GnriQZXEKM
Name 3-[2'-Methoxycarbonylpropionyl)amino]-5-[2'-methyl-3'-phenylpropenylidene]-2-thioxothiazolidin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H18N2O4S2
InChI InChI=1S/C18H18N2O4S2/c1-11(9-13-7-5-4-6-8-13)10-14-16(22)20(18(25)26-14)19-15(21)12(2)17(23)24-3/h4-10,12H,1-3H3,(H,19,21)/b11-9+,14-10-
InChIKey AODOFXNOBVKWDU-VDVFTDKOSA-N
Molecular Weight 390.472 g/mol
SMILES N(N1C(\C(=C\C(=C\c2ccccc2)C)SC1=S)=O)C(C(C(=O)OC)C)=O
SPLASH splash10-0006-0900000000-b4c820b5a82d2def9915
Source of Spectrum Y-32-1023-3
Synonyms methyl 2-methyl-3-({(5Z)-5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}amino)-3-oxopropanoate
Wiley ID 1364635