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

Systemtic Name: N-[[2-(1,3-benzodioxol-5-yl)-6-ethylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Openeye Name: N-[[2-(1,3-benzodioxol-5-yl)-6-ethylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide CAS Name: N-[[2-(1,3-benzodioxol-5-yl)-6-(ethylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide IUPAC Name: N-[[2-(1,3-benzodioxol-5-yl)-6-ethylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Traditional Name: N-[[2-(1,3-benzodioxol-5-yl)-6-(ethylthio)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN2C(=NC(=C2CNC(=O)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C=C1

Isomeric SMILES

CCSC1=NN2C(=NC(=C2CNC(=O)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C=C1

InChI

InChI=1S/C23H20N4O3S/c1-2-31-21-11-10-20-25-22(16-8-9-18-19(12-16)30-14-29-18)17(27(20)26-21)13-24-23(28)15-6-4-3-5-7-15/h3-12H,2,13-14H2,1H3,(H,24,28)