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

Systemtic Name: 6-(4-chlorophenyl)-2-[2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 2-[2-(4-benzylsulfonylpiperazin-1-yl)ethyl]-6-(4-chlorophenyl)pyridazin-3-one CAS Name: 6-(4-chlorophenyl)-2-[2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 2-[2-(4-benzylsulfonylpiperazin-1-yl)ethyl]-6-(4-chlorophenyl)pyridazin-3-one Traditional Name: 2-[2-(4-benzylsulfonylpiperazino)ethyl]-6-(4-chlorophenyl)pyridazin-3-one Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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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)CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN4O3S/c24-21-8-6-20(7-9-21)22-10-11-23(29)28(25-22)17-14-26-12-15-27(16-13-26)32(30,31)18-19-4-2-1-3-5-19/h1-11H,12-18H2