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

Systemtic Name: N-[4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[4-[3-(tert-butylsulfamoyl)-4-methyl-phenyl]phthalazin-1-yl]amino]phenyl]acetamide CAS Name: N-[4-[[4-[3-(tert-butylsulfamoyl)-4-methylphenyl]-1-phthalazinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[4-[3-(tert-butylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[4-[3-(tert-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:

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

InChI

InChI=1S/C27H29N5O3S/c1-17-10-11-19(16-24(17)36(34,35)32-27(3,4)5)25-22-8-6-7-9-23(22)26(31-30-25)29-21-14-12-20(13-15-21)28-18(2)33/h6-16,32H,1-5H3,(H,28,33)(H,29,31)