N-[3-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]propyl]-2-methoxy-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]propyl]-2-methoxy-4-methyl-benzenesulfonamide Openeye Name: N-[3-[3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]propyl]-2-methoxy-4-methyl-benzenesulfonamide CAS Name: N-[3-[3-(4-fluorophenyl)-6-oxo-1-pyridazinyl]propyl]-2-methoxy-4-methylbenzenesulfonamide IUPAC Name: N-[3-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]propyl]-2-methoxy-4-methylbenzenesulfonamide Traditional Name: N-[3-[3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]propyl]-2-methoxy-4-methyl-benzenesulfonamide Formula: C21H22FN3O4S MolecularWeight: 431.480483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H22FN3O4S/c1-15-4-10-20(19(14-15)29-2)30(27,28)23-12-3-13-25-21(26)11-9-18(24-25)16-5-7-17(22)8-6-16/h4-11,14,23H,3,12-13H2,1-2H3