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8-Butyl-3,3-dimethyl-6-(4-tosylpiperazino)-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
SpectraBase Compound ID 6wUq4eYao5H
InChI InChI=1S/C26H34N4O2S2/c1-5-6-7-24-23-18-33-26(3,4)16-21(23)22(17-27)25(28-24)29-12-14-30(15-13-29)34(31,32)20-10-8-19(2)9-11-20/h8-11H,5-7,12-16,18H2,1-4H3
InChIKey CTWKJEVADOWQQI-UHFFFAOYSA-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 LXtD4bVXY2X
Name 8-Butyl-3,3-dimethyl-6-(4-tosylpiperazino)-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
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Formula C26H34N4O2S2
InChI InChI=1S/C26H34N4O2S2/c1-5-6-7-24-23-18-33-26(3,4)16-21(23)22(17-27)25(28-24)29-12-14-30(15-13-29)34(31,32)20-10-8-19(2)9-11-20/h8-11H,5-7,12-16,18H2,1-4H3
InChIKey CTWKJEVADOWQQI-UHFFFAOYSA-N
Molecular Weight 498.704 g/mol
SMILES CCCCc1c2CSC(Cc2c(c(N2CCN(S(c3ccc(cc3)C)(=O)=O)CC2)n1)C#N)(C)C
SPLASH splash10-0006-6009000000-a9d7b9613302752fa17d
Synonyms 8-Butyl-3,3-dimethyl-6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile 8-Butyl-3,3-dimethyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile 8-Butyl-3,3-dimethyl-6-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
Wiley ID 1457741