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

Systemtic Name: 5-[4-[(4-methoxyphenyl)amino]phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide Openeye Name: 5-[4-(4-methoxyanilino)phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide CAS Name: 5-[4-(4-methoxyanilino)-1-phthalazinyl]-N,2-dimethylbenzenesulfonamide IUPAC Name: 5-[4-(4-methoxyanilino)phthalazin-1-yl]-N,2-dimethylbenzenesulfonamide Traditional Name: N,2-dimethyl-5-[4-(p-anisidino)phthalazin-1-yl]benzenesulfonamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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)OC)S(=O)(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O3S/c1-15-8-9-16(14-21(15)31(28,29)24-2)22-19-6-4-5-7-20(19)23(27-26-22)25-17-10-12-18(30-3)13-11-17/h4-14,24H,1-3H3,(H,25,27)