5-[4-[(3,4-dichlorophenyl)amino]phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide

Systemtic Name: 5-[4-[(3,4-dichlorophenyl)amino]phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide Openeye Name: 5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide CAS Name: 5-[4-(3,4-dichloroanilino)-1-phthalazinyl]-N,2-dimethylbenzenesulfonamide IUPAC Name: 5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-N,2-dimethylbenzenesulfonamide Traditional Name: 5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide Formula: C22H18Cl2N4O2S MolecularWeight: 473.37492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)Cl)Cl)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)Cl)Cl)S(=O)(=O)NC

InChI

InChI=1S/C22H18Cl2N4O2S/c1-13-7-8-14(11-20(13)31(29,30)25-2)21-16-5-3-4-6-17(16)22(28-27-21)26-15-9-10-18(23)19(24)12-15/h3-12,25H,1-2H3,(H,26,28)