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

Systemtic Name: 6-(4-chlorophenyl)-2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 6-(4-chlorophenyl)-2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-chlorophenyl)-2-[2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 6-(4-chlorophenyl)-2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Traditional Name: 6-(4-chlorophenyl)-2-[2-[4-(2-nitrophenyl)sulfonylpiperazino]ethyl]pyridazin-3-one Formula: C22H22ClN5O5S MolecularWeight: 503.95858

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)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN5O5S/c23-18-7-5-17(6-8-18)19-9-10-22(29)27(24-19)16-13-25-11-14-26(15-12-25)34(32,33)21-4-2-1-3-20(21)28(30)31/h1-10H,11-16H2