6-(4-fluorophenyl)-2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(4-fluorophenyl)-2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(4-fluorophenyl)-2-[2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-fluorophenyl)-2-[2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-fluorophenyl)-2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 6-(4-fluorophenyl)-2-[2-[4-(2-thienylsulfonyl)piperazino]ethyl]pyridazin-3-one Formula: C20H21FN4O3S2 MolecularWeight: 448.534143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H21FN4O3S2/c21-17-5-3-16(4-6-17)18-7-8-19(26)25(22-18)14-11-23-9-12-24(13-10-23)30(27,28)20-2-1-15-29-20/h1-8,15H,9-14H2