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N-[[2-[(E)-2-phenylethenyl]-6-(3-pyridinylmethylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide
SpectraBase Compound ID B2wa5aqXxls
InChI InChI=1S/C28H23N5OS/c34-28(23-11-5-2-6-12-23)30-19-25-24(14-13-21-8-3-1-4-9-21)31-26-15-16-27(32-33(25)26)35-20-22-10-7-17-29-18-22/h1-18H,19-20H2,(H,30,34)/b14-13+
InChIKey NZYSLKJFZFKKMV-BUHFOSPRSA-N
Mol Weight 477.59 g/mol
Molecular Formula C28H23N5OS
Exact Mass 477.162332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ef3hbD8hOWx
Name N-[[2-[(E)-2-phenylethenyl]-6-(3-pyridinylmethylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide
Alternate Name(s) N-[[2-[(E)-2-phenylethenyl]-6-(pyridin-3-ylmethylsulfanyl)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide N-[[6-(3-pyridylmethylsulfanyl)-2-[(E)-styryl]imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide N-[[6-(3-pyridylmethylthio)-2-[(E)-styryl]imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide
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Formula C28H23N5OS
InChI InChI=1S/C28H23N5OS/c34-28(23-11-5-2-6-12-23)30-19-25-24(14-13-21-8-3-1-4-9-21)31-26-15-16-27(32-33(25)26)35-20-22-10-7-17-29-18-22/h1-18H,19-20H2,(H,30,34)/b14-13+
InChIKey NZYSLKJFZFKKMV-BUHFOSPRSA-N
Molecular Weight 477.586 g/mol
SMILES N(C(=O)c1ccccc1)Cc1[n]2c(nc1\C=C\c1ccccc1)C=CC(=N2)SCc1cnccc1
SPLASH splash10-0a4i-3901000000-1a6b3bfb36af8f331e57
Source of Spectrum B-47-1989-0
Wiley ID 1394568