2-[(2-ethylphenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-ethylphenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-ethylphenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-ethylanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-ethylphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(2-ethylphenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C13H22N3S+ MolecularWeight: 252.39888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NCC[NH+](C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C13H21N3S/c1-4-11-7-5-6-8-12(11)15-13(17)14-9-10-16(2)3/h5-8H,4,9-10H2,1-3H3,(H2,14,15,17)/p+1