N-(1H-benzimidazol-2-ylmethyl)-2-methyl-5-(4-phenylazanylphthalazin-1-yl)benzenesulfonamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-methyl-5-(4-phenylazanylphthalazin-1-yl)benzenesulfonamide Openeye Name: 5-(4-anilinophthalazin-1-yl)-N-(1H-benzimidazol-2-ylmethyl)-2-methyl-benzenesulfonamide CAS Name: 5-(4-anilino-1-phthalazinyl)-N-(1H-benzimidazol-2-ylmethyl)-2-methylbenzenesulfonamide IUPAC Name: 5-(4-anilinophthalazin-1-yl)-N-(1H-benzimidazol-2-ylmethyl)-2-methylbenzenesulfonamide Traditional Name: 5-(4-anilinophthalazin-1-yl)-N-(1H-benzimidazol-2-ylmethyl)-2-methyl-benzenesulfonamide Formula: C29H24N6O2S MolecularWeight: 520.60486

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=CC=C4)S(=O)(=O)NCC5=NC6=CC=CC=C6N5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4)S(=O)(=O)NCC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C29H24N6O2S/c1-19-15-16-20(17-26(19)38(36,37)30-18-27-32-24-13-7-8-14-25(24)33-27)28-22-11-5-6-12-23(22)29(35-34-28)31-21-9-3-2-4-10-21/h2-17,30H,18H2,1H3,(H,31,35)(H,32,33)