4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl]amino]-N-(2-methylphenyl)benzamide

Systemtic Name: 4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl]amino]-N-(2-methylphenyl)benzamide Openeye Name: 4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl]amino]-N-(o-tolyl)benzamide CAS Name: 4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]-1-phthalazinyl]amino]-N-(2-methylphenyl)benzamide IUPAC Name: 4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl]amino]-N-(2-methylphenyl)benzamide Traditional Name: 4-[[4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl]amino]-N-(o-tolyl)benzamide Formula: C30H27N5O3S MolecularWeight: 537.63208

Click to see the large picture

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)NC5=CC=CC=C5C)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5C)S(=O)(=O)NC

InChI

InChI=1S/C30H27N5O3S/c1-19-8-4-7-11-26(19)33-30(36)21-14-16-23(17-15-21)32-29-25-10-6-5-9-24(25)28(34-35-29)22-13-12-20(2)27(18-22)39(37,38)31-3/h4-18,31H,1-3H3,(H,32,35)(H,33,36)