3-[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonyl-N-(2-methylphenyl)propanamide

Systemtic Name: 3-[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonyl-N-(2-methylphenyl)propanamide Openeye Name: 3-[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonyl-N-(o-tolyl)propanamide CAS Name: 3-[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonyl-N-(2-methylphenyl)propanamide IUPAC Name: 3-[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonyl-N-(2-methylphenyl)propanamide Traditional Name: 3-[5-(6-keto-1H-pyridazin-3-yl)-2-methyl-phenyl]sulfonyl-N-(o-tolyl)propionamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)CCC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)CCC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H21N3O4S/c1-14-5-3-4-6-17(14)22-20(25)11-12-29(27,28)19-13-16(8-7-15(19)2)18-9-10-21(26)24-23-18/h3-10,13H,11-12H2,1-2H3,(H,22,25)(H,24,26)