1-(2,5-dimethylphenyl)-N-(2-methyl-5-methylsulfonyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: 1-(2,5-dimethylphenyl)-N-(2-methyl-5-methylsulfonyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: 1-(2,5-dimethylphenyl)-N-(2-methyl-5-methylsulfonyl-phenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: 1-(2,5-dimethylphenyl)-N-(2-methyl-5-methylsulfonylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: 1-(2,5-dimethylphenyl)-N-(2-methyl-5-methylsulfonylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(2,5-dimethylphenyl)-6-keto-N-(5-mesyl-2-methyl-phenyl)-4,5-dihydropyridazine-3-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H23N3O4S/c1-13-5-6-15(3)19(11-13)24-20(25)10-9-17(23-24)21(26)22-18-12-16(29(4,27)28)8-7-14(18)2/h5-8,11-12H,9-10H2,1-4H3,(H,22,26)