(4-methylsulfanylphenyl)methyl-propan-2-yl-azanium

Systemtic Name: (4-methylsulfanylphenyl)methyl-propan-2-yl-azanium Openeye Name: isopropyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [4-(methylthio)phenyl]methyl-propan-2-ylammonium IUPAC Name: (4-methylsulfanylphenyl)methyl-propan-2-ylazanium Traditional Name: isopropyl-[4-(methylthio)benzyl]ammonium Formula: C11H18NS+ MolecularWeight: 196.33232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NS/c1-9(2)12-8-10-4-6-11(13-3)7-5-10/h4-7,9,12H,8H2,1-3H3/p+1