1-(5-bromanyl-2-methoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(5-bromanyl-2-methoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(5-bromo-2-methoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(5-bromo-2-methoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)OC

Isomeric SMILES

CC1=CC(=C(C=C1Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)OC

InChI

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