3-[5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Openeye Name: 3-[5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-2-thienyl]-1H-pyridazin-6-one CAS Name: 3-[5-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]sulfonyl]-2-thiophenyl]-1H-pyridazin-6-one IUPAC Name: 3-[5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Traditional Name: 3-[5-[4-[bis(4-fluorophenyl)methyl]piperazino]sulfonyl-2-thienyl]-1H-pyridazin-6-one Formula: C25H22F2N4O3S2 MolecularWeight: 528.593986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(S4)C5=NNC(=O)C=C5

Isomeric SMILES

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(S4)C5=NNC(=O)C=C5

InChI

InChI=1S/C25H22F2N4O3S2/c26-19-5-1-17(2-6-19)25(18-3-7-20(27)8-4-18)30-13-15-31(16-14-30)36(33,34)24-12-10-22(35-24)21-9-11-23(32)29-28-21/h1-12,25H,13-16H2,(H,29,32)