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

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methylphenyl)methylsulfanyl]propan-1-one Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(p-tolylmethylsulfanyl)propan-1-one CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-3-[(4-methylphenyl)methylthio]-1-propanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(4-methylphenyl)methylsulfanyl]propan-1-one Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-3-[(4-methylbenzyl)thio]propan-1-one Formula: C21H25FN2OS MolecularWeight: 372.499403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CSCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2OS/c1-17-2-4-18(5-3-17)16-26-15-10-21(25)24-13-11-23(12-14-24)20-8-6-19(22)7-9-20/h2-9H,10-16H2,1H3