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

Systemtic Name: 6-(4-chlorophenyl)-2-[2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 6-(4-chlorophenyl)-2-[2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-chlorophenyl)-2-[2-[4-(4-phenylphenyl)sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 6-(4-chlorophenyl)-2-[2-[4-(4-phenylphenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Traditional Name: 6-(4-chlorophenyl)-2-[2-[4-(4-phenylphenyl)sulfonylpiperazino]ethyl]pyridazin-3-one Formula: C28H27ClN4O3S MolecularWeight: 535.05698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27ClN4O3S/c29-25-10-6-24(7-11-25)27-14-15-28(34)33(30-27)21-18-31-16-19-32(20-17-31)37(35,36)26-12-8-23(9-13-26)22-4-2-1-3-5-22/h1-15H,16-21H2