2-methyl-5-(4-piperidin-1-ylphthalazin-1-yl)-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-(4-piperidin-1-ylphthalazin-1-yl)-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: 2-methyl-5-[4-(1-piperidyl)phthalazin-1-yl]-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: 2-methyl-5-[4-(1-piperidinyl)-1-phthalazinyl]-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: 2-methyl-5-(4-piperidin-1-ylphthalazin-1-yl)-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: 2-methyl-5-(4-piperidinophthalazin-1-yl)-N-(2-pyridylmethyl)benzenesulfonamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCCCC4)S(=O)(=O)NCC5=CC=CC=N5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCCCC4)S(=O)(=O)NCC5=CC=CC=N5

InChI

InChI=1S/C26H27N5O2S/c1-19-12-13-20(17-24(19)34(32,33)28-18-21-9-5-6-14-27-21)25-22-10-3-4-11-23(22)26(30-29-25)31-15-7-2-8-16-31/h3-6,9-14,17,28H,2,7-8,15-16,18H2,1H3