[(2S)-4-methylsulfanyl-1-oxidanylidene-1-piperazin-1-yl-butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-piperazin-1-yl-butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfanyl-1-(piperazine-1-carbonyl)propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(1-piperazinyl)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-piperazin-1-ylbutan-2-yl]azanium Traditional Name: [(1S)-3-(methylthio)-1-(piperazine-1-carbonyl)propyl]ammonium Formula: C9H20N3OS+ MolecularWeight: 218.3396

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCNCC1)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCNCC1)[NH3+]

InChI

InChI=1S/C9H19N3OS/c1-14-7-2-8(10)9(13)12-5-3-11-4-6-12/h8,11H,2-7,10H2,1H3/p+1/t8-/m0/s1