1-[[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl]-4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl]-4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperazine CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[[1-(difluoromethyl)-2-imidazolyl]methyl]piperazine IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperazine Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperazine Formula: C16H16ClF5N4O2S MolecularWeight: 458.833856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC=CN2C(F)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=NC=CN2C(F)F)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C16H16ClF5N4O2S/c17-13-2-1-11(9-12(13)16(20,21)22)29(27,28)25-7-5-24(6-8-25)10-14-23-3-4-26(14)15(18)19/h1-4,9,15H,5-8,10H2