3-[5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Openeye Name: 3-[5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2-thienyl]-1H-pyridazin-6-one CAS Name: 3-[5-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]-2-thiophenyl]-1H-pyridazin-6-one IUPAC Name: 3-[5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Traditional Name: 3-[5-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonyl-2-thienyl]-1H-pyridazin-6-one Formula: C19H17F3N4O3S2 MolecularWeight: 470.48849

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(S3)C4=NNC(=O)C=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(S3)C4=NNC(=O)C=C4

InChI

InChI=1S/C19H17F3N4O3S2/c20-19(21,22)13-2-1-3-14(12-13)25-8-10-26(11-9-25)31(28,29)18-7-5-16(30-18)15-4-6-17(27)24-23-15/h1-7,12H,8-11H2,(H,24,27)