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

Systemtic Name: 2-[2-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[2-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 2-[2-[4-(4-fluoro-3-methylphenyl)sulfonyl-1-piperazinyl]ethyl]-6-(4-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(4-fluoro-3-methylphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazino]ethyl]-6-(4-methoxyphenyl)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)OC)F

Isomeric SMILES

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

InChI

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