ethyl 3-[[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 3-[[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonylamino]benzoate Openeye Name: ethyl 3-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]benzoate CAS Name: 3-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]benzoate Traditional Name: 3-[[5-(6-keto-1H-pyridazin-3-yl)-2-methyl-phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C3=NNC(=O)C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C3=NNC(=O)C=C3)C

InChI

InChI=1S/C20H19N3O5S/c1-3-28-20(25)15-5-4-6-16(11-15)23-29(26,27)18-12-14(8-7-13(18)2)17-9-10-19(24)22-21-17/h4-12,23H,3H2,1-2H3,(H,22,24)