1-(2,5-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)CC2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)CC2)C3=C(C=CC(=C3)C)C

InChI

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