(4-dimethylaminophenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium Formula: C18H25N2S+ MolecularWeight: 301.4695

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H24N2S/c1-14(16-7-11-18(21-4)12-8-16)19-13-15-5-9-17(10-6-15)20(2)3/h5-12,14,19H,13H2,1-4H3/p+1/t14-/m0/s1