N-(cyanomethyl)-3,4-dimethoxy-N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: N-(cyanomethyl)-3,4-dimethoxy-N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: N-(cyanomethyl)-3,4-dimethoxy-N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: N-(cyanomethyl)-3,4-dimethoxy-N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzenesulfonamide IUPAC Name: N-(cyanomethyl)-3,4-dimethoxy-N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: N-(cyanomethyl)-N-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)N(CC#N)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)N(CC#N)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N4O5S/c1-14-12-20(26)23-24-21(14)15-4-6-16(7-5-15)25(11-10-22)31(27,28)17-8-9-18(29-2)19(13-17)30-3/h4-9,13-14H,11-12H2,1-3H3,(H,23,26)