N-(4-fluorophenyl)-2-[4-[2-(4-methylphenyl)sulfanylethanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-[2-(4-methylphenyl)sulfanylethanoyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-[2-(p-tolylsulfanyl)acetyl]piperazin-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[2-[(4-methylphenyl)thio]-1-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-[2-(4-methylphenyl)sulfanylacetyl]piperazin-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-[2-(p-tolylthio)acetyl]piperazino]acetamide Formula: C21H24FN3O2S MolecularWeight: 401.497563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O2S/c1-16-2-8-19(9-3-16)28-15-21(27)25-12-10-24(11-13-25)14-20(26)23-18-6-4-17(22)5-7-18/h2-9H,10-15H2,1H3,(H,23,26)