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

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfanyl-1-(4-phenylpiperazine-1-carbonyl)propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(4-phenyl-1-piperazinyl)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]azanium Traditional Name: [(1S)-3-(methylthio)-1-(4-phenylpiperazine-1-carbonyl)propyl]ammonium Formula: C15H24N3OS+ MolecularWeight: 294.43556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C15H23N3OS/c1-20-12-7-14(16)15(19)18-10-8-17(9-11-18)13-5-3-2-4-6-13/h2-6,14H,7-12,16H2,1H3/p+1/t14-/m0/s1