(2S)-2-phenylsulfanyl-1-piperazin-1-yl-propan-1-one

Systemtic Name: (2S)-2-phenylsulfanyl-1-piperazin-1-yl-propan-1-one Openeye Name: (2S)-2-phenylsulfanyl-1-piperazin-1-yl-propan-1-one CAS Name: (2S)-2-(phenylthio)-1-(1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-phenylsulfanyl-1-piperazin-1-ylpropan-1-one Traditional Name: (2S)-2-(phenylthio)-1-piperazino-propan-1-one Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2OS/c1-11(17-12-5-3-2-4-6-12)13(16)15-9-7-14-8-10-15/h2-6,11,14H,7-10H2,1H3/t11-/m0/s1