2-(1,3-benzodioxol-5-yl)-2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-propan-2-ylphenyl)sulfonyl-ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-propan-2-ylphenyl)sulfonyl-ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(4-isopropylphenyl)sulfonyl-2-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-2-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]-N-(4-propan-2-ylphenyl)sulfonylacetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(4-propan-2-ylphenyl)sulfonylacetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]-N-p-cumenylsulfonyl-acetamide Formula: C29H27N3O7S MolecularWeight: 561.60558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)N4C(=O)C=CC(=N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)N4C(=O)C=CC(=N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H27N3O7S/c1-18(2)19-6-11-23(12-7-19)40(35,36)31-29(34)28(21-8-14-25-26(16-21)39-17-38-25)32-27(33)15-13-24(30-32)20-4-9-22(37-3)10-5-20/h4-16,18,28H,17H2,1-3H3,(H,31,34)