2-(6-phenylpyridazin-3-yl)sulfanyl-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanone Openeye Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanone CAS Name: 2-[(6-phenyl-3-pyridazinyl)thio]-1-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethanone IUPAC Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanone Traditional Name: 2-[(6-phenylpyridazin-3-yl)thio]-1-[4-[3-(trifluoromethyl)phenyl]piperazino]ethanone Formula: C23H21F3N4OS MolecularWeight: 458.49925

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21F3N4OS/c24-23(25,26)18-7-4-8-19(15-18)29-11-13-30(14-12-29)22(31)16-32-21-10-9-20(27-28-21)17-5-2-1-3-6-17/h1-10,15H,11-14,16H2