N-(4-fluorophenyl)-2-methyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide

Systemtic Name: N-(4-fluorophenyl)-2-methyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide Openeye Name: N-(4-fluorophenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide CAS Name: N-(4-fluorophenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide IUPAC Name: N-(4-fluorophenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide Traditional Name: N-(4-fluorophenyl)-5-(4-keto-3H-phthalazin-1-yl)-2-methyl-benzenesulfonamide Formula: C21H16FN3O3S MolecularWeight: 409.433443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O3S/c1-13-6-7-14(20-17-4-2-3-5-18(17)21(26)24-23-20)12-19(13)29(27,28)25-16-10-8-15(22)9-11-16/h2-12,25H,1H3,(H,24,26)