5-[4-[(4-fluorophenyl)amino]phthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide

Systemtic Name: 5-[4-[(4-fluorophenyl)amino]phthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide Openeye Name: 5-[4-(4-fluoroanilino)phthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide CAS Name: 5-[4-(4-fluoroanilino)-1-phthalazinyl]-N,N,2-trimethylbenzenesulfonamide IUPAC Name: 5-[4-(4-fluoroanilino)phthalazin-1-yl]-N,N,2-trimethylbenzenesulfonamide Traditional Name: 5-[4-(4-fluoroanilino)phthalazin-1-yl]-N,N,2-trimethyl-benzenesulfonamide Formula: C23H21FN4O2S MolecularWeight: 436.501843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21FN4O2S/c1-15-8-9-16(14-21(15)31(29,30)28(2)3)22-19-6-4-5-7-20(19)23(27-26-22)25-18-12-10-17(24)11-13-18/h4-14H,1-3H3,(H,25,27)