2-[(2-ethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-ethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-ethylphenyl)carbamothioyl-[1-(2-furyl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-ethylanilino)-sulfanylidenemethyl]-[1-(2-furanyl)ethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-ethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2-ethylphenyl)thiocarbamoyl-[1-(2-furyl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C19H28N3OS+ MolecularWeight: 346.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC[NH+](C)C)C(C)C2=CC=CO2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC[NH+](C)C)C(C)C2=CC=CO2

InChI

InChI=1S/C19H27N3OS/c1-5-16-9-6-7-10-17(16)20-19(24)22(13-12-21(3)4)15(2)18-11-8-14-23-18/h6-11,14-15H,5,12-13H2,1-4H3,(H,20,24)/p+1