1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperazine Openeye Name: 1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperazine CAS Name: 1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethylphenyl)sulfonylpiperazine Traditional Name: 1-[bis(4-fluorophenyl)methyl]-4-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperazine Formula: C27H30F2N2O3S MolecularWeight: 500.600506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C)C)OC

InChI

InChI=1S/C27H30F2N2O3S/c1-18-17-25(34-4)19(2)20(3)27(18)35(32,33)31-15-13-30(14-16-31)26(21-5-9-23(28)10-6-21)22-7-11-24(29)12-8-22/h5-12,17,26H,13-16H2,1-4H3