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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC=CC=C2

InChI

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