N-(1H-benzimidazol-2-ylmethyl)-5-[4-[(3,4-dichlorophenyl)amino]phthalazin-1-yl]-2-methyl-benzenesulfonamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-[(3,4-dichlorophenyl)amino]phthalazin-1-yl]-2-methyl-benzenesulfonamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methyl-benzenesulfonamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(3,4-dichloroanilino)-1-phthalazinyl]-2-methylbenzenesulfonamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methyl-benzenesulfonamide Formula: C29H22Cl2N6O2S MolecularWeight: 589.49498

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

InChI

InChI=1S/C29H22Cl2N6O2S/c1-17-10-11-18(14-26(17)40(38,39)32-16-27-34-24-8-4-5-9-25(24)35-27)28-20-6-2-3-7-21(20)29(37-36-28)33-19-12-13-22(30)23(31)15-19/h2-15,32H,16H2,1H3,(H,33,37)(H,34,35)