N-[[2-(1,3-benzodioxol-5-yl)-6-phenylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide

Systemtic Name: N-[[2-(1,3-benzodioxol-5-yl)-6-phenylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Openeye Name: N-[[2-(1,3-benzodioxol-5-yl)-6-phenylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide CAS Name: N-[[2-(1,3-benzodioxol-5-yl)-6-(phenylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide IUPAC Name: N-[[2-(1,3-benzodioxol-5-yl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Traditional Name: N-[[2-(1,3-benzodioxol-5-yl)-6-(phenylthio)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Formula: C27H20N4O3S MolecularWeight: 480.5377

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(N4C(=N3)C=CC(=N4)SC5=CC=CC=C5)CNC(=O)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(N4C(=N3)C=CC(=N4)SC5=CC=CC=C5)CNC(=O)C6=CC=CC=C6

InChI

InChI=1S/C27H20N4O3S/c32-27(18-7-3-1-4-8-18)28-16-21-26(19-11-12-22-23(15-19)34-17-33-22)29-24-13-14-25(30-31(21)24)35-20-9-5-2-6-10-20/h1-15H,16-17H2,(H,28,32)