N-[[2-(4-methoxyphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide

Systemtic Name: N-[[2-(4-methoxyphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Openeye Name: N-[[2-(4-methoxyphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide CAS Name: N-[[2-(4-methoxyphenyl)-6-(methylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide IUPAC Name: N-[[2-(4-methoxyphenyl)-6-methylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Traditional Name: N-[[2-(4-methoxyphenyl)-6-(methylthio)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N3C(=N2)C=CC(=N3)SC)CNC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N3C(=N2)C=CC(=N3)SC)CNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-28-17-10-8-15(9-11-17)21-18(14-23-22(27)16-6-4-3-5-7-16)26-19(24-21)12-13-20(25-26)29-2/h3-13H,14H2,1-2H3,(H,23,27)