4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide

Systemtic Name: 4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide Openeye Name: 4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide CAS Name: 4-[[4-[3-(tert-butylsulfamoyl)-4-methylphenyl]-1-phthalazinyl]amino]benzamide IUPAC Name: 4-[[4-[3-(tert-butylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]benzamide Traditional Name: 4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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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)C

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)C

InChI

InChI=1S/C26H27N5O3S/c1-16-9-10-18(15-22(16)35(33,34)31-26(2,3)4)23-20-7-5-6-8-21(20)25(30-29-23)28-19-13-11-17(12-14-19)24(27)32/h5-15,31H,1-4H3,(H2,27,32)(H,28,30)