4-[[4-[3-(dimethylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]-N,N-diethyl-benzamide

Systemtic Name: 4-[[4-[3-(dimethylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]-N,N-diethyl-benzamide Openeye Name: 4-[[4-[3-(dimethylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[4-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-phthalazinyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[4-[3-(dimethylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[4-[3-(dimethylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]-N,N-diethyl-benzamide Formula: C28H31N5O3S MolecularWeight: 517.64244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)N(C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C28H31N5O3S/c1-6-33(7-2)28(34)20-14-16-22(17-15-20)29-27-24-11-9-8-10-23(24)26(30-31-27)21-13-12-19(3)25(18-21)37(35,36)32(4)5/h8-18H,6-7H2,1-5H3,(H,29,31)