(2S)-3-methyl-2-phenylsulfanyl-1-piperazin-1-yl-butan-1-one

Systemtic Name: (2S)-3-methyl-2-phenylsulfanyl-1-piperazin-1-yl-butan-1-one Openeye Name: (2S)-3-methyl-2-phenylsulfanyl-1-piperazin-1-yl-butan-1-one CAS Name: (2S)-3-methyl-2-(phenylthio)-1-(1-piperazinyl)-1-butanone IUPAC Name: (2S)-3-methyl-2-phenylsulfanyl-1-piperazin-1-ylbutan-1-one Traditional Name: (2S)-3-methyl-2-(phenylthio)-1-piperazino-butan-1-one Formula: C15H22N2OS MolecularWeight: 278.41298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCNCC1)SC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCNCC1)SC2=CC=CC=C2

InChI

InChI=1S/C15H22N2OS/c1-12(2)14(19-13-6-4-3-5-7-13)15(18)17-10-8-16-9-11-17/h3-7,12,14,16H,8-11H2,1-2H3/t14-/m0/s1