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

Systemtic Name: (4-methylphenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-methylsulfanylphenyl)ethyl]-(p-tolylmethyl)ammonium CAS Name: (4-methylphenyl)methyl-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium IUPAC Name: (4-methylphenyl)methyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium Traditional Name: (4-methylbenzyl)-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium Formula: C17H22NS+ MolecularWeight: 272.42828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]C(C)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+][C@@H](C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H21NS/c1-13-4-6-15(7-5-13)12-18-14(2)16-8-10-17(19-3)11-9-16/h4-11,14,18H,12H2,1-3H3/p+1/t14-/m0/s1