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(5E)-1-acetyl-5-[(6-methyl-2-piperidin-1-ylquinolin-3-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
SpectraBase Compound ID GErCk2B9MDX
InChI InChI=1S/C21H22N4O2S/c1-13-6-7-17-15(10-13)11-16(19(22-17)24-8-4-3-5-9-24)12-18-20(27)23-21(28)25(18)14(2)26/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,27,28)/b18-12+
InChIKey IVIMMEWWTLDJHC-LDADJPATSA-N
Mol Weight 394.49 g/mol
Molecular Formula C21H22N4O2S
Exact Mass 394.146347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVlM2Z6wQAv
Name (5E)-1-acetyl-5-[(6-methyl-2-piperidin-1-ylquinolin-3-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
Alternate Name(s) (5E)-1-acetyl-5-[(6-methyl-2-piperidino-3-quinolyl)methylene]-2-thioxo-4-imidazolidinone (5E)-1-acetyl-5-[[6-methyl-2-(1-piperidinyl)-3-quinolinyl]methylidene]-2-sulfanylidene-4-imidazolidinone (5E)-1-acetyl-5-[[6-methyl-2-(1-piperidyl)-3-quinolyl]methylene]-2-thioxo-imidazolidin-4-one (5E)-1-ethanoyl-5-[(6-methyl-2-piperidin-1-yl-quinolin-3-yl)methylidene]-2-sulfanylidene-imidazolidin-4-one
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Formula C21H22N4O2S
InChI InChI=1S/C21H22N4O2S/c1-13-6-7-17-15(10-13)11-16(19(22-17)24-8-4-3-5-9-24)12-18-20(27)23-21(28)25(18)14(2)26/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,23,27,28)/b18-12+
InChIKey IVIMMEWWTLDJHC-LDADJPATSA-N
Molecular Weight 394.493 g/mol
SMILES N1C(\C(N(C1=S)C(=O)C)=C/c1c(nc2c(c1)cc(cc2)C)N1CCCCC1)=O
SPLASH splash10-0006-9460000000-5e1aad79c3a985127b7f
Wiley ID 1453002