2-[4-[4-(3-chloranyl-4-fluoranyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[4-[4-(3-chloranyl-4-fluoranyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[4-[4-(3-chloro-4-fluoro-phenyl)piperazin-1-yl]-4-oxo-butyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[4-[4-(3-chloro-4-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[4-[4-(3-chloro-4-fluorophenyl)piperazin-1-yl]-4-oxobutyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[4-[4-(3-chloro-4-fluoro-phenyl)piperazino]-4-keto-butyl]-6-(2-thienyl)pyridazin-3-one Formula: C22H22ClFN4O2S MolecularWeight: 460.952083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)F)Cl)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)F)Cl)C(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H22ClFN4O2S/c23-17-15-16(5-6-18(17)24)26-10-12-27(13-11-26)21(29)4-1-9-28-22(30)8-7-19(25-28)20-3-2-14-31-20/h2-3,5-8,14-15H,1,4,9-13H2