1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,5-dimethylphenyl)piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrF3N2O3S/c1-13-3-4-14(2)16(11-13)24-7-9-25(10-8-24)29(26,27)18-6-5-15(20)12-17(18)28-19(21,22)23/h3-6,11-12H,7-10H2,1-2H3