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

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxy-benzenesulfonamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-4-phenoxybenzenesulfonamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenoxybenzenesulfonamide Traditional Name: N-[3-[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(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

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

InChI

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