4-[[4-[4-methyl-3-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]phenyl]phthalazin-1-yl]amino]benzamide

Systemtic Name: 4-[[4-[4-methyl-3-[(2-methyl-1-oxidanyl-propan-2-yl)sulfamoyl]phenyl]phthalazin-1-yl]amino]benzamide Openeye Name: 4-[[4-[3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide CAS Name: 4-[[4-[3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl]-1-phthalazinyl]amino]benzamide IUPAC Name: 4-[[4-[3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl]phthalazin-1-yl]amino]benzamide Traditional Name: 4-[[4-[3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide Formula: C26H27N5O4S MolecularWeight: 505.58868

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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=C(C=C4)C(=O)N)S(=O)(=O)NC(C)(C)CO

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)N)S(=O)(=O)NC(C)(C)CO

InChI

InChI=1S/C26H27N5O4S/c1-16-8-9-18(14-22(16)36(34,35)31-26(2,3)15-32)23-20-6-4-5-7-21(20)25(30-29-23)28-19-12-10-17(11-13-19)24(27)33/h4-14,31-32H,15H2,1-3H3,(H2,27,33)(H,28,30)