3-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(3-chlorophenyl)methylthio]-1-[4-(2-fluorophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-[(3-chlorobenzyl)thio]-1-[4-(2-fluorophenyl)piperazino]propan-1-one Formula: C20H22ClFN2OS MolecularWeight: 392.917883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClFN2OS/c21-17-5-3-4-16(14-17)15-26-13-8-20(25)24-11-9-23(10-12-24)19-7-2-1-6-18(19)22/h1-7,14H,8-13,15H2