(6R)-4,6-dimethyl-1-(2-methylsulfanylphenyl)piperazin-4-ium-2-one

Systemtic Name: (6R)-4,6-dimethyl-1-(2-methylsulfanylphenyl)piperazin-4-ium-2-one Openeye Name: (6R)-4,6-dimethyl-1-(2-methylsulfanylphenyl)piperazin-4-ium-2-one CAS Name: (6R)-4,6-dimethyl-1-[2-(methylthio)phenyl]-2-piperazin-4-iumone IUPAC Name: (6R)-4,6-dimethyl-1-(2-methylsulfanylphenyl)piperazin-4-ium-2-one Traditional Name: (6R)-4,6-dimethyl-1-[2-(methylthio)phenyl]piperazin-4-ium-2-one Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(=O)N1C2=CC=CC=C2SC)C

Isomeric SMILES

C[C@@H]1C[NH+](CC(=O)N1C2=CC=CC=C2SC)C

InChI

InChI=1S/C13H18N2OS/c1-10-8-14(2)9-13(16)15(10)11-6-4-5-7-12(11)17-3/h4-7,10H,8-9H2,1-3H3/p+1/t10-/m1/s1