1-[(2S)-1-methylsulfanylpropan-2-yl]-4-(phenylmethyl)piperidin-1-ium

Systemtic Name: 1-[(2S)-1-methylsulfanylpropan-2-yl]-4-(phenylmethyl)piperidin-1-ium Openeye Name: 4-benzyl-1-[(1S)-1-methyl-2-methylsulfanyl-ethyl]piperidin-1-ium CAS Name: 1-[(2S)-1-(methylthio)propan-2-yl]-4-(phenylmethyl)piperidin-1-ium IUPAC Name: 4-benzyl-1-[(2S)-1-methylsulfanylpropan-2-yl]piperidin-1-ium Traditional Name: 4-benzyl-1-[(1S)-1-methyl-2-(methylthio)ethyl]piperidin-1-ium Formula: C16H26NS+ MolecularWeight: 264.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC)[NH+]1CCC(CC1)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](CSC)[NH+]1CCC(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H25NS/c1-14(13-18-2)17-10-8-16(9-11-17)12-15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3/p+1/t14-/m0/s1