diethyl-[(1S)-2-(3-methylsulfanylpropylazaniumyl)-1-phenyl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-(3-methylsulfanylpropylazaniumyl)-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-(3-methylsulfanylpropylammonio)-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-[3-(methylthio)propylammonio]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-(3-methylsulfanylpropylazaniumyl)-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-[3-(methylthio)propylammonio]-1-phenyl-ethyl]ammonium Formula: C16H30N2S+2 MolecularWeight: 282.4878

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH2+]CCCSC)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2S/c1-4-18(5-2)16(14-17-12-9-13-19-3)15-10-7-6-8-11-15/h6-8,10-11,16-17H,4-5,9,12-14H2,1-3H3/p+2/t16-/m1/s1