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

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-[(2-fluorophenyl)methylthio]-1-propanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(2-fluorophenyl)methylsulfanyl]propan-1-one Traditional Name: 1-[4-(2,3-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=C(C(=CC=C1)N2CCN(CC2)C(=O)CCSCC3=CC=CC=C3F)C

Isomeric SMILES

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

InChI

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