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

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-2-methyl-benzenesulfonamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-2-methyl-benzenesulfonamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(1,3-benzodioxol-5-ylamino)-1-phthalazinyl]-2-methylbenzenesulfonamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-2-methylbenzenesulfonamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-5-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-2-methyl-benzenesulfonamide Formula: C30H24N6O4S MolecularWeight: 564.61436

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=CC5=C(C=C4)OCO5)S(=O)(=O)NCC6=NC7=CC=CC=C7N6

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5)S(=O)(=O)NCC6=NC7=CC=CC=C7N6

InChI

InChI=1S/C30H24N6O4S/c1-18-10-11-19(14-27(18)41(37,38)31-16-28-33-23-8-4-5-9-24(23)34-28)29-21-6-2-3-7-22(21)30(36-35-29)32-20-12-13-25-26(15-20)40-17-39-25/h2-15,31H,16-17H2,1H3,(H,32,36)(H,33,34)