2-(2,5-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(2,5-dimethylphenyl)thio]-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(2,5-dimethylphenyl)thio]-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C20H23FN2OS MolecularWeight: 358.472823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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