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

Systemtic Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-[(4-fluorophenyl)methylsulfanyl]ethanone Openeye Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-[(4-fluorophenyl)methylsulfanyl]ethanone CAS Name: 1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-[(4-fluorophenyl)methylthio]ethanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-[(4-fluorophenyl)methylsulfanyl]ethanone Traditional Name: 1-[4-(2,5-dimethylphenyl)piperazino]-2-[(4-fluorobenzyl)thio]ethanone Formula: C21H25FN2OS MolecularWeight: 372.499403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2OS/c1-16-3-4-17(2)20(13-16)23-9-11-24(12-10-23)21(25)15-26-14-18-5-7-19(22)8-6-18/h3-8,13H,9-12,14-15H2,1-2H3