1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-methylphenyl)piperazine

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-methylphenyl)piperazine Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(m-tolyl)piperazine CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-methylphenyl)piperazine IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-methylphenyl)piperazine Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(m-tolyl)piperazine Formula: C19H18F6N2O2S MolecularWeight: 452.413839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H18F6N2O2S/c1-13-3-2-4-16(9-13)26-5-7-27(8-6-26)30(28,29)17-11-14(18(20,21)22)10-15(12-17)19(23,24)25/h2-4,9-12H,5-8H2,1H3