dimethyl-[1-(4-methylsulfanylphenyl)-1-oxidanylidene-butan-2-yl]-(phenylmethyl)azanium

Systemtic Name: dimethyl-[1-(4-methylsulfanylphenyl)-1-oxidanylidene-butan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-dimethyl-[1-(4-methylsulfanylbenzoyl)propyl]ammonium CAS Name: dimethyl-[1-[4-(methylthio)phenyl]-1-oxobutan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-dimethyl-[1-(4-methylsulfanylphenyl)-1-oxobutan-2-yl]azanium Traditional Name: benzyl-dimethyl-[1-[4-(methylthio)benzoyl]propyl]ammonium Formula: C20H26NOS+ MolecularWeight: 328.49154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26NOS/c1-5-19(20(22)17-11-13-18(23-4)14-12-17)21(2,3)15-16-9-7-6-8-10-16/h6-14,19H,5,15H2,1-4H3/q+1