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

Systemtic Name: dimethyl-[3-[[(3-methylphenyl)-(phenylmethyl)carbamothioyl]amino]propyl]azanium Openeye Name: 3-[[benzyl(m-tolyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[(3-methyl-N-(phenylmethyl)anilino)-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: 3-[[benzyl-(3-methylphenyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[benzyl(m-tolyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C20H28N3S+ MolecularWeight: 342.52142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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