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2-[4'-Methyl-5-(phenylazo)-1',3'-thiazol-2'-yl]-3-[(4"-piperidin-1''-yl)phenyl]-acrylonitrile
SpectraBase Compound ID DbRz3lSiwD7
InChI InChI=1S/C24H23N5S/c1-18-23(28-27-21-8-4-2-5-9-21)30-24(26-18)20(17-25)16-19-10-12-22(13-11-19)29-14-6-3-7-15-29/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3/b20-16+,28-27+
InChIKey JPGODEFZMXFCAK-IQIIPECGSA-N
Mol Weight 413.54 g/mol
Molecular Formula C24H23N5S
Exact Mass 413.167417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XyHTq4HD4x
Name 2-[4'-Methyl-5-(phenylazo)-1',3'-thiazol-2'-yl]-3-[(4"-piperidin-1''-yl)phenyl]-acrylonitrile
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Formula C24H23N5S
InChI InChI=1S/C24H23N5S/c1-18-23(28-27-21-8-4-2-5-9-21)30-24(26-18)20(17-25)16-19-10-12-22(13-11-19)29-14-6-3-7-15-29/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3/b20-16+,28-27+
InChIKey JPGODEFZMXFCAK-IQIIPECGSA-N
Molecular Weight 413.543 g/mol
SMILES c1(sc(\N=N\c2ccccc2)c(n1)C)\C(=C\c1ccc(N2CCCCC2)cc1)C#N
SPLASH splash10-03di-0110900000-0a61452005e7ba99a9b6
Source of Spectrum AH-140-435-10a
Wiley ID 1696151