2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C20H22ClFN2O2S MolecularWeight: 408.917283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSCC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H22ClFN2O2S/c1-26-16-7-5-15(6-8-16)23-9-11-24(12-10-23)20(25)14-27-13-17-18(21)3-2-4-19(17)22/h2-8H,9-14H2,1H3