2,3-dihydro-1,4-benzodioxin-3-yl-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[oxo-[4-(trifluoromethylthio)phenyl]methyl]-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[4-(trifluoromethylthio)benzoyl]piperazino]methanone Formula: C21H19F3N2O4S MolecularWeight: 452.44677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2COC3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)SC(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2COC3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)SC(F)(F)F

InChI

InChI=1S/C21H19F3N2O4S/c22-21(23,24)31-15-7-5-14(6-8-15)19(27)25-9-11-26(12-10-25)20(28)18-13-29-16-3-1-2-4-17(16)30-18/h1-8,18H,9-13H2