2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-methyl-phenyl)sulfanyl-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-methyl-phenyl)sulfanyl-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-bromo-2-methylphenyl)thio]-1-[4-(2-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-methylphenyl)sulfanyl-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]-1-[4-(2-fluorophenyl)piperazino]ethanone Formula: C19H20BrFN2OS MolecularWeight: 423.342303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C19H20BrFN2OS/c1-14-12-15(20)6-7-18(14)25-13-19(24)23-10-8-22(9-11-23)17-5-3-2-4-16(17)21/h2-7,12H,8-11,13H2,1H3