N-tert-butyl-5-[4-[(4-methoxyphenyl)amino]phthalazin-1-yl]-2-methyl-benzenesulfonamide

Systemtic Name: N-tert-butyl-5-[4-[(4-methoxyphenyl)amino]phthalazin-1-yl]-2-methyl-benzenesulfonamide Openeye Name: N-tert-butyl-5-[4-(4-methoxyanilino)phthalazin-1-yl]-2-methyl-benzenesulfonamide CAS Name: N-tert-butyl-5-[4-(4-methoxyanilino)-1-phthalazinyl]-2-methylbenzenesulfonamide IUPAC Name: N-tert-butyl-5-[4-(4-methoxyanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide Traditional Name: N-tert-butyl-2-methyl-5-[4-(p-anisidino)phthalazin-1-yl]benzenesulfonamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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(C)(C)C

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(C)(C)C

InChI

InChI=1S/C26H28N4O3S/c1-17-10-11-18(16-23(17)34(31,32)30-26(2,3)4)24-21-8-6-7-9-22(21)25(29-28-24)27-19-12-14-20(33-5)15-13-19/h6-16,30H,1-5H3,(H,27,29)