2-[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one

Systemtic Name: 2-[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one Openeye Name: 2-[2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one CAS Name: 2-[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]-6-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-3-pyridazinone IUPAC Name: 2-[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-[2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl]-6-(4-methyl-3-pyrrolidinosulfonyl-phenyl)pyridazin-3-one Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)N2C(=O)C=CC(=N2)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)N2C(=O)C=CC(=N2)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C26H29N3O4S/c1-17-7-10-22(15-19(17)3)26(31)20(4)29-25(30)12-11-23(27-29)21-9-8-18(2)24(16-21)34(32,33)28-13-5-6-14-28/h7-12,15-16,20H,5-6,13-14H2,1-4H3