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

Systemtic Name: 6-(4-fluorophenyl)-2-[2-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 6-(4-fluorophenyl)-2-[2-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-fluorophenyl)-2-[2-[4-(4-methoxy-3-methylphenyl)sulfonyl-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 6-(4-fluorophenyl)-2-[2-[4-(4-methoxy-3-methylphenyl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Traditional Name: 6-(4-fluorophenyl)-2-[2-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazino]ethyl]pyridazin-3-one Formula: C24H27FN4O4S MolecularWeight: 486.558983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C24H27FN4O4S/c1-18-17-21(7-9-23(18)33-2)34(31,32)28-14-11-27(12-15-28)13-16-29-24(30)10-8-22(26-29)19-3-5-20(25)6-4-19/h3-10,17H,11-16H2,1-2H3