6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one CAS Name: 6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 6-(4-chlorophenyl)-2-[2-(4-phenethylsulfonylpiperazino)ethyl]pyridazin-3-one Formula: C24H27ClN4O3S MolecularWeight: 487.01418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O3S/c25-22-8-6-21(7-9-22)23-10-11-24(30)29(26-23)18-15-27-13-16-28(17-14-27)33(31,32)19-12-20-4-2-1-3-5-20/h1-11H,12-19H2