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2-((4-(1-Benzylpiperidin-4-yl)butyl)amino)-6-chloro-4- phenylpyridine-3,5-dicarbonitrile
SpectraBase Compound ID J4EWvn1ZCWb
InChI InChI=1S/C29H30ClN5/c30-28-25(19-31)27(24-12-5-2-6-13-24)26(20-32)29(34-28)33-16-8-7-9-22-14-17-35(18-15-22)21-23-10-3-1-4-11-23/h1-6,10-13,22H,7-9,14-18,21H2,(H,33,34)
InChIKey NXFUAVRJMVGTEU-UHFFFAOYSA-N
Mol Weight 484.05 g/mol
Molecular Formula C29H30ClN5
Exact Mass 483.218974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1tDqKkMi0W
Name 2-((4-(1-Benzylpiperidin-4-yl)butyl)amino)-6-chloro-4- phenylpyridine-3,5-dicarbonitrile
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Formula C29H30ClN5
InChI InChI=1S/C29H30ClN5/c30-28-25(19-31)27(24-12-5-2-6-13-24)26(20-32)29(34-28)33-16-8-7-9-22-14-17-35(18-15-22)21-23-10-3-1-4-11-23/h1-6,10-13,22H,7-9,14-18,21H2,(H,33,34)
InChIKey NXFUAVRJMVGTEU-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.ejmech.2013.06.021
Molecular Weight 484.047 g/mol
SMILES N(c1nc(c(c(c1C#N)-c1ccccc1)C#N)Cl)CCCCC1CCN(Cc2ccccc2)CC1
SPLASH splash10-00l6-7062900000-97638d9bbd72074ea6d0
Source of Spectrum EMC-67-72-4
Synonyms 2-((4-(1-benzylpiperidin-4-yl)butyl)amino)-6-chloro-4-phenylpyridine-3,5-dicarbonitrile 2-Chloro-4-phenyl-6-[4-[1-(phenylmethyl)-4-piperidinyl]butylamino]pyridine-3,5-dicarbonitrile 2-[4-(1-benzylpiperidin-4-yl)butylamino]-6-chloro-4-phenylpyridine-3,5-dicarbonitrile 2-[4-(1-benzyl-4-piperidyl)butylamino]-6-chloro-4-phenyl-pyridine-3,5-dicarbonitrile 2-Chloranyl-4-phenyl-6-[4-[1-(phenylmethyl)piperidin-4-yl]butylamino]pyridine-3,5-dicarbonitrile
Wiley ID 1755188