2-[(3,5-dimethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3,5-dimethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(3,5-dimethylphenyl)carbamothioyl-[1-(2-furyl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3,5-dimethylanilino)-sulfanylidenemethyl]-[1-(2-furanyl)ethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3,5-dimethylphenyl)carbamothioyl-[1-(furan-2-yl)ethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(3,5-dimethylphenyl)thiocarbamoyl-[1-(2-furyl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C19H28N3OS+ MolecularWeight: 346.51012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(CC[NH+](C)C)C(C)C2=CC=CO2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(CC[NH+](C)C)C(C)C2=CC=CO2)C

InChI

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