2-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone CAS Name: 2-[(3-chlorophenyl)methylthio]-1-[4-(2-hydroxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3-chlorobenzyl)thio]-1-[4-(2-hydroxyethyl)piperazino]ethanone Formula: C15H21ClN2O2S MolecularWeight: 328.85744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CCN1CCO)C(=O)CSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H21ClN2O2S/c16-14-3-1-2-13(10-14)11-21-12-15(20)18-6-4-17(5-7-18)8-9-19/h1-3,10,19H,4-9,11-12H2