4-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-2-methyl-1-(3-methylphenyl)piperazine

Systemtic Name: 4-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-2-methyl-1-(3-methylphenyl)piperazine Openeye Name: 4-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-2-methyl-1-(m-tolyl)piperazine CAS Name: 4-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-2-methyl-1-(3-methylphenyl)piperazine IUPAC Name: 4-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-2-methyl-1-(3-methylphenyl)piperazine Traditional Name: 4-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-2-methyl-1-(m-tolyl)piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

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