[(1R)-1-(furan-2-yl)-2-[2-(2-methylphenyl)sulfanylethanoylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(furan-2-yl)-2-[2-(2-methylphenyl)sulfanylethanoylamino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(2-furyl)-2-[[2-(o-tolylsulfanyl)acetyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(2-furanyl)-2-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(furan-2-yl)-2-[[2-(2-methylphenyl)sulfanylacetyl]amino]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(2-furyl)-2-[[2-(o-tolylthio)acetyl]amino]ethyl]-dimethyl-ammonium Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NCC(C2=CC=CO2)[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC[C@H](C2=CC=CO2)[NH+](C)C

InChI

InChI=1S/C17H22N2O2S/c1-13-7-4-5-9-16(13)22-12-17(20)18-11-14(19(2)3)15-8-6-10-21-15/h4-10,14H,11-12H2,1-3H3,(H,18,20)/p+1/t14-/m1/s1