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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(6-oxidanylidene-3-propyl-pyridazin-1-yl)-N-(4-propan-2-ylphenyl)sulfonyl-ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(4-isopropylphenyl)sulfonyl-2-(6-oxo-3-propyl-pyridazin-1-yl)acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(6-oxo-3-propyl-1-pyridazinyl)-N-(4-propan-2-ylphenyl)sulfonylacetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(6-oxo-3-propylpyridazin-1-yl)-N-(4-propan-2-ylphenyl)sulfonylacetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(6-keto-3-propyl-pyridazin-1-yl)-N-p-cumenylsulfonyl-acetamide Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C=C1)C(C2=CC3=C(C=C2)OCO3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCCC1=NN(C(=O)C=C1)C(C2=CC3=C(C=C2)OCO3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C25H27N3O6S/c1-4-5-19-9-13-23(29)28(26-19)24(18-8-12-21-22(14-18)34-15-33-21)25(30)27-35(31,32)20-10-6-17(7-11-20)16(2)3/h6-14,16,24H,4-5,15H2,1-3H3,(H,27,30)