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

Systemtic Name: 5-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-N-(oxolan-2-ylmethyl)benzenesulfonamide Openeye Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide CAS Name: 5-[4-(2,4-dimethylanilino)-1-phthalazinyl]-2-methyl-N-(2-oxolanylmethyl)benzenesulfonamide IUPAC Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(oxolan-2-ylmethyl)benzenesulfonamide Traditional Name: 5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-N-(tetrahydrofurfuryl)benzenesulfonamide Formula: C28H30N4O3S MolecularWeight: 502.6278

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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)NCC5CCCO5)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)NCC5CCCO5)C

InChI

InChI=1S/C28H30N4O3S/c1-18-10-13-25(20(3)15-18)30-28-24-9-5-4-8-23(24)27(31-32-28)21-12-11-19(2)26(16-21)36(33,34)29-17-22-7-6-14-35-22/h4-5,8-13,15-16,22,29H,6-7,14,17H2,1-3H3,(H,30,32)