2-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: methylsulfonyl-[2-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]ethyl]azanide IUPAC Name: 2-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]ethyl-methylsulfonylazanide Traditional Name: mesyl-[2-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]ethyl]azanide Formula: C12H20N2O2S2 MolecularWeight: 288.4294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C12H19N2O2S2/c1-10(13-8-9-14-18(3,15)16)11-4-6-12(17-2)7-5-11/h4-7,10,13H,8-9H2,1-3H3/q-1/p+1/t10-/m0/s1