2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C22H25FN2O3S MolecularWeight: 416.508903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O3S/c1-16(26)17-3-8-21(28-2)18(13-17)14-29-15-22(27)25-11-9-24(10-12-25)20-6-4-19(23)5-7-20/h3-8,13H,9-12,14-15H2,1-2H3