1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-phenylsulfanyl-butan-1-one

Systemtic Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-phenylsulfanyl-butan-1-one Openeye Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-phenylsulfanyl-butan-1-one CAS Name: 1-[4-(2-hydroxyethyl)-1-piperazinyl]-4-(phenylthio)-1-butanone IUPAC Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-phenylsulfanylbutan-1-one Traditional Name: 1-[4-(2-hydroxyethyl)piperazino]-4-(phenylthio)butan-1-one Formula: C16H24N2O2S MolecularWeight: 308.43896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCO)C(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C16H24N2O2S/c19-13-12-17-8-10-18(11-9-17)16(20)7-4-14-21-15-5-2-1-3-6-15/h1-3,5-6,19H,4,7-14H2