5-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: 5-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: 5-[4-(2,4-dimethylanilino)-1-phthalazinyl]-2-methyl-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(2-pyridylmethyl)benzenesulfonamide Formula: C29H27N5O2S MolecularWeight: 509.62198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)NCC5=CC=CC=N5)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)NCC5=CC=CC=N5)C

InChI

InChI=1S/C29H27N5O2S/c1-19-11-14-26(21(3)16-19)32-29-25-10-5-4-9-24(25)28(33-34-29)22-13-12-20(2)27(17-22)37(35,36)31-18-23-8-6-7-15-30-23/h4-17,31H,18H2,1-3H3,(H,32,34)