N-tert-butyl-2-methyl-5-[4-[(3-methylphenyl)amino]phthalazin-1-yl]benzenesulfonamide

Systemtic Name: N-tert-butyl-2-methyl-5-[4-[(3-methylphenyl)amino]phthalazin-1-yl]benzenesulfonamide Openeye Name: N-tert-butyl-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzenesulfonamide CAS Name: N-tert-butyl-2-methyl-5-[4-(3-methylanilino)-1-phthalazinyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzenesulfonamide Traditional Name: N-tert-butyl-2-methyl-5-[4-(m-toluidino)phthalazin-1-yl]benzenesulfonamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O2S/c1-17-9-8-10-20(15-17)27-25-22-12-7-6-11-21(22)24(28-29-25)19-14-13-18(2)23(16-19)33(31,32)30-26(3,4)5/h6-16,30H,1-5H3,(H,27,29)