N-(4-hydroxyphenyl)-2-methyl-5-[4-[(phenylmethyl)amino]phthalazin-1-yl]benzenesulfonamide

Systemtic Name: N-(4-hydroxyphenyl)-2-methyl-5-[4-[(phenylmethyl)amino]phthalazin-1-yl]benzenesulfonamide Openeye Name: 5-[4-(benzylamino)phthalazin-1-yl]-N-(4-hydroxyphenyl)-2-methyl-benzenesulfonamide CAS Name: N-(4-hydroxyphenyl)-2-methyl-5-[4-[(phenylmethyl)amino]-1-phthalazinyl]benzenesulfonamide IUPAC Name: 5-[4-(benzylamino)phthalazin-1-yl]-N-(4-hydroxyphenyl)-2-methylbenzenesulfonamide Traditional Name: 5-[4-(benzylamino)phthalazin-1-yl]-N-(4-hydroxyphenyl)-2-methyl-benzenesulfonamide Formula: C28H24N4O3S MolecularWeight: 496.58016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=CC=CC=C4)S(=O)(=O)NC5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCC4=CC=CC=C4)S(=O)(=O)NC5=CC=C(C=C5)O

InChI

InChI=1S/C28H24N4O3S/c1-19-11-12-21(17-26(19)36(34,35)32-22-13-15-23(33)16-14-22)27-24-9-5-6-10-25(24)28(31-30-27)29-18-20-7-3-2-4-8-20/h2-17,32-33H,18H2,1H3,(H,29,31)