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

Systemtic Name: 2-[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl]-6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyridazin-3-one Openeye Name: 2-[2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl]-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one CAS Name: 2-[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]-6-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-pyridazinone IUPAC Name: 2-[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]-6-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-[2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl]-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one Formula: C26H29N3O5S MolecularWeight: 495.59056

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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)N4CCOCC4)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)N4CCOCC4)C

InChI

InChI=1S/C26H29N3O5S/c1-17-5-8-22(15-19(17)3)26(31)20(4)29-25(30)10-9-23(27-29)21-7-6-18(2)24(16-21)35(32,33)28-11-13-34-14-12-28/h5-10,15-16,20H,11-14H2,1-4H3