5-ethanoyl-2-ethyl-4-[(3-methoxyphenyl)amino]-6-(4-methylsulfinylphenyl)pyridazin-3-one

Systemtic Name: 5-ethanoyl-2-ethyl-4-[(3-methoxyphenyl)amino]-6-(4-methylsulfinylphenyl)pyridazin-3-one Openeye Name: 5-acetyl-2-ethyl-4-(3-methoxyanilino)-6-(4-methylsulfinylphenyl)pyridazin-3-one CAS Name: 5-acetyl-2-ethyl-4-(3-methoxyanilino)-6-(4-methylsulfinylphenyl)-3-pyridazinone IUPAC Name: 5-acetyl-2-ethyl-4-(3-methoxyanilino)-6-(4-methylsulfinylphenyl)pyridazin-3-one Traditional Name: 5-acetyl-2-ethyl-4-(m-anisidino)-6-(4-methylsulfinylphenyl)pyridazin-3-one Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=C(C=C2)S(=O)C)C(=O)C)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=C(C=C2)S(=O)C)C(=O)C)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H23N3O4S/c1-5-25-22(27)21(23-16-7-6-8-17(13-16)29-3)19(14(2)26)20(24-25)15-9-11-18(12-10-15)30(4)28/h6-13,23H,5H2,1-4H3