N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide

Systemtic Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide Openeye Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide CAS Name: N-[4-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-4-phenoxybenzenesulfonamide IUPAC Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxybenzenesulfonamide Traditional Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide Formula: C28H28N4O3S MolecularWeight: 500.61192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3S/c33-36(34,26-16-14-25(15-17-26)35-24-8-4-3-5-9-24)31-23-12-10-22(11-13-23)27-18-19-28(30-29-27)32-20-6-1-2-7-21-32/h3-5,8-19,31H,1-2,6-7,20-21H2