dimethyl-[3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]ammonio]propyl]ammonium CAS Name: dimethyl-[3-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]azanium Traditional Name: dimethyl-[3-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]propyl]ammonium Formula: C14H26N2S+2 MolecularWeight: 254.43464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CCC[NH+](C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C14H24N2S/c1-12(15-10-5-11-16(2)3)13-6-8-14(17-4)9-7-13/h6-9,12,15H,5,10-11H2,1-4H3/p+2/t12-/m0/s1