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4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[[dihydro-3-octyl-4-oxo-2-thioxo-5(2H)-thiazolyliden]methyl]-7-methyl-2-(1-piperidinyl)-
SpectraBase Compound ID AZGqYpEUWan
InChI InChI=1S/C26H34N4O2S2/c1-3-4-5-6-7-11-16-29-25(32)21(34-26(29)33)17-20-23(28-14-9-8-10-15-28)27-22-13-12-19(2)18-30(22)24(20)31/h12-13,17-18H,3-11,14-16H2,1-2H3/b21-17+
InChIKey NLXAJFPNGDVKQQ-HEHNFIMWSA-N
Mol Weight 498.7 g/mol
Molecular Formula C26H34N4O2S2
Exact Mass 498.212319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4tPI9A5hmD
Name 4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[[dihydro-3-octyl-4-oxo-2-thioxo-5(2H)-thiazolyliden]methyl]-7-methyl-2-(1-piperidinyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34N4O2S2
InChI InChI=1S/C26H34N4O2S2/c1-3-4-5-6-7-11-16-29-25(32)21(34-26(29)33)17-20-23(28-14-9-8-10-15-28)27-22-13-12-19(2)18-30(22)24(20)31/h12-13,17-18H,3-11,14-16H2,1-2H3/b21-17+
InChIKey NLXAJFPNGDVKQQ-HEHNFIMWSA-N
Molecular Weight 498.704 g/mol
SMILES C1(=C(N=C2N(C1=O)C=C(C=C2)C)N1CCCCC1)\C=C/1C(N(CCCCCCCC)C(S1)=S)=O
SPLASH splash10-0udl-3290000000-ca4231f2add1d5971c5a
Source of Spectrum IY-1-4558-2
Synonyms (5E)-5-[[7-methyl-4-oxo-2-(1-piperidinyl)-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-octyl-2-sulfanylidene-4-thiazolidinone (5E)-5-[(7-methyl-4-oxo-2-piperidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one (5E)-5-[[7-methyl-4-oxo-2-(1-piperidyl)pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-octyl-2-thioxo-thiazolidin-4-one (5E)-5-[(7-methyl-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one
Wiley ID 1653565