2-methyl-5-[4-(naphthalen-2-ylamino)phthalazin-1-yl]-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-[4-(naphthalen-2-ylamino)phthalazin-1-yl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 2-methyl-5-[4-(2-naphthylamino)phthalazin-1-yl]-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 2-methyl-5-[4-(2-naphthalenylamino)-1-phthalazinyl]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 2-methyl-5-[4-(naphthalen-2-ylamino)phthalazin-1-yl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 2-methyl-5-[4-(2-naphthylamino)phthalazin-1-yl]-N-(3-pyridylmethyl)benzenesulfonamide Formula: C31H25N5O2S MolecularWeight: 531.6275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=CC=CC=C5C=C4)S(=O)(=O)NCC6=CN=CC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=CC=CC=C5C=C4)S(=O)(=O)NCC6=CN=CC=C6

InChI

InChI=1S/C31H25N5O2S/c1-21-12-13-25(18-29(21)39(37,38)33-20-22-7-6-16-32-19-22)30-27-10-4-5-11-28(27)31(36-35-30)34-26-15-14-23-8-2-3-9-24(23)17-26/h2-19,33H,20H2,1H3,(H,34,36)