2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(tetrahydrofuran-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-chlorophenyl)methylthio]-1-[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-chlorobenzyl)thio]-1-[4-(tetrahydrofuran-2-carbonyl)piperazino]ethanone Formula: C18H23ClN2O3S MolecularWeight: 382.90482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC(OC1)C(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN2O3S/c19-15-5-3-14(4-6-15)12-25-13-17(22)20-7-9-21(10-8-20)18(23)16-2-1-11-24-16/h3-6,16H,1-2,7-13H2