3-[3-(dimethylazaniumyl)propyl-[(2,3-dimethylphenyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[3-(dimethylazaniumyl)propyl-[(2,3-dimethylphenyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[3-(dimethylammonio)propyl-[(2,3-dimethylphenyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[3-(dimethylammonio)propyl-[(2,3-dimethylanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[3-(dimethylazaniumyl)propyl-[(2,3-dimethylphenyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[3-(dimethylammonio)propyl-[(2,3-dimethylphenyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C19H36N4S+2 MolecularWeight: 352.58094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H34N4S/c1-16-10-7-11-18(17(16)2)20-19(24)23(14-8-12-21(3)4)15-9-13-22(5)6/h7,10-11H,8-9,12-15H2,1-6H3,(H,20,24)/p+2