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

Systemtic Name: N,N-dimethyl-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]-N,N-dimethyl-benzamide CAS Name: 4-[[4-[3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl]-1-phthalazinyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[4-[3-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methylphenyl]phthalazin-1-yl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[4-[3-[(2-hydroxy-1,1-dimethyl-ethyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]-N,N-dimethyl-benzamide Formula: C28H31N5O4S MolecularWeight: 533.64184

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

InChI

InChI=1S/C28H31N5O4S/c1-18-10-11-20(16-24(18)38(36,37)32-28(2,3)17-34)25-22-8-6-7-9-23(22)26(31-30-25)29-21-14-12-19(13-15-21)27(35)33(4)5/h6-16,32,34H,17H2,1-5H3,(H,29,31)