1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-oxo-pyridazine-3-carboxamide CAS Name: 1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-butyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-6-keto-pyridazine-3-carboxamide Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O4S/c1-2-3-14-26-20(27)13-12-19(24-26)21(28)23-16-6-8-17(9-7-16)25-31(29,30)18-10-4-15(22)5-11-18/h4-13,25H,2-3,14H2,1H3,(H,23,28)