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

Systemtic Name: N-tert-butyl-5-[4-[(2,5-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-benzenesulfonamide Openeye Name: N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methyl-benzenesulfonamide CAS Name: N-tert-butyl-5-[4-(2,5-dimethylanilino)-1-phthalazinyl]-2-methylbenzenesulfonamide IUPAC Name: N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methylbenzenesulfonamide Traditional Name: N-tert-butyl-5-[4-(2,5-dimethylanilino)phthalazin-1-yl]-2-methyl-benzenesulfonamide Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N4O2S/c1-17-11-12-18(2)23(15-17)28-26-22-10-8-7-9-21(22)25(29-30-26)20-14-13-19(3)24(16-20)34(32,33)31-27(4,5)6/h7-16,31H,1-6H3,(H,28,30)