N-tert-butyl-2-methyl-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide

Systemtic Name: N-tert-butyl-2-methyl-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide Openeye Name: N-tert-butyl-2-methyl-5-[4-(1-naphthylamino)phthalazin-1-yl]benzenesulfonamide CAS Name: N-tert-butyl-2-methyl-5-[4-(1-naphthalenylamino)-1-phthalazinyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-methyl-5-[4-(naphthalen-1-ylamino)phthalazin-1-yl]benzenesulfonamide Traditional Name: N-tert-butyl-2-methyl-5-[4-(1-naphthylamino)phthalazin-1-yl]benzenesulfonamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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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=CC5=CC=CC=C54)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC5=CC=CC=C54)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C29H28N4O2S/c1-19-16-17-21(18-26(19)36(34,35)33-29(2,3)4)27-23-13-7-8-14-24(23)28(32-31-27)30-25-15-9-11-20-10-5-6-12-22(20)25/h5-18,33H,1-4H3,(H,30,32)