1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one

Systemtic Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one Openeye Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one CAS Name: 1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[(2-fluorophenyl)methylthio]-1-propanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one Traditional Name: 1-[4-(2,5-dimethylphenyl)piperazino]-3-[(2-fluorobenzyl)thio]propan-1-one Formula: C22H27FN2OS MolecularWeight: 386.525983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCSCC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCSCC3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2OS/c1-17-7-8-18(2)21(15-17)24-10-12-25(13-11-24)22(26)9-14-27-16-19-5-3-4-6-20(19)23/h3-8,15H,9-14,16H2,1-2H3