2-[4-[[4-[3-(butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]ethanamide

Systemtic Name: 2-[4-[[4-[3-(butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]ethanamide Openeye Name: 2-[4-[[4-[3-(butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]acetamide CAS Name: 2-[4-[[4-[3-(butylsulfamoyl)-4-methylphenyl]-1-phthalazinyl]amino]phenyl]acetamide IUPAC Name: 2-[4-[[4-[3-(butylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]phenyl]acetamide Traditional Name: 2-[4-[[4-[3-(butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]acetamide Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)CC(=O)N)C

Isomeric SMILES

CCCCNS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)CC(=O)N)C

InChI

InChI=1S/C27H29N5O3S/c1-3-4-15-29-36(34,35)24-17-20(12-9-18(24)2)26-22-7-5-6-8-23(22)27(32-31-26)30-21-13-10-19(11-14-21)16-25(28)33/h5-14,17,29H,3-4,15-16H2,1-2H3,(H2,28,33)(H,30,32)