dimethyl-[3-[(2-methylphenyl)carbamothioyl-(phenylmethyl)amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(2-methylphenyl)carbamothioyl-(phenylmethyl)amino]propyl]azanium Openeye Name: 3-[benzyl(o-tolylcarbamothioyl)amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[(2-methylanilino)-sulfanylidenemethyl]-(phenylmethyl)amino]propyl]ammonium IUPAC Name: 3-[benzyl-[(2-methylphenyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[benzyl(o-tolylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C20H28N3S+ MolecularWeight: 342.52142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N(CCC[NH+](C)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N(CCC[NH+](C)C)CC2=CC=CC=C2

InChI

InChI=1S/C20H27N3S/c1-17-10-7-8-13-19(17)21-20(24)23(15-9-14-22(2)3)16-18-11-5-4-6-12-18/h4-8,10-13H,9,14-16H2,1-3H3,(H,21,24)/p+1