6-phenyl-2-[2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one

Systemtic Name: 6-phenyl-2-[2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 2-[2-(4-benzylsulfonylpiperazin-1-yl)ethyl]-6-phenyl-pyridazin-3-one CAS Name: 6-phenyl-2-[2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 2-[2-(4-benzylsulfonylpiperazin-1-yl)ethyl]-6-phenylpyridazin-3-one Traditional Name: 2-[2-(4-benzylsulfonylpiperazino)ethyl]-6-phenyl-pyridazin-3-one Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c28-23-12-11-22(21-9-5-2-6-10-21)24-27(23)18-15-25-13-16-26(17-14-25)31(29,30)19-20-7-3-1-4-8-20/h1-12H,13-19H2