2-methyl-N-(2-methyl-1-oxidanyl-propan-2-yl)-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide

Systemtic Name: 2-methyl-N-(2-methyl-1-oxidanyl-propan-2-yl)-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide Openeye Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-2-methyl-5-[4-(1-naphthylamino)phthalazin-1-yl]benzenesulfonamide CAS Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-[4-(1-naphthalenylamino)-1-phthalazinyl]benzenesulfonamide IUPAC Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide Traditional Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-2-methyl-5-[4-(1-naphthylamino)phthalazin-1-yl]benzenesulfonamide Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC5=CC=CC=C54)S(=O)(=O)NC(C)(C)CO

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC5=CC=CC=C54)S(=O)(=O)NC(C)(C)CO

InChI

InChI=1S/C29H28N4O3S/c1-19-15-16-21(17-26(19)37(35,36)33-29(2,3)18-34)27-23-12-6-7-13-24(23)28(32-31-27)30-25-14-8-10-20-9-4-5-11-22(20)25/h4-17,33-34H,18H2,1-3H3,(H,30,32)