2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(3,4-dimethylphenyl)thio]-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3,4-dimethylphenyl)thio]-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C20H23FN2OS MolecularWeight: 358.472823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23FN2OS/c1-15-3-8-19(13-16(15)2)25-14-20(24)23-11-9-22(10-12-23)18-6-4-17(21)5-7-18/h3-8,13H,9-12,14H2,1-2H3