3-thiophen-3-yl-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-thiophen-3-yl-1-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(3-thienyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(3-thiophenyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-thiophen-3-yl-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(3-thienyl)-1-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazino]propan-1-one Formula: C18H19F3N2O4S2 MolecularWeight: 448.47967

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CSC=C2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CSC=C2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H19F3N2O4S2/c19-18(20,21)27-15-2-4-16(5-3-15)29(25,26)23-10-8-22(9-11-23)17(24)6-1-14-7-12-28-13-14/h2-5,7,12-13H,1,6,8-11H2