2-[(3,4-dimethylphenyl)carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3,4-dimethylphenyl)carbamothioyl-(phenylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzyl-[(3,4-dimethylphenyl)carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3,4-dimethylanilino)-sulfanylidenemethyl]-(phenylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzyl-[(3,4-dimethylphenyl)carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[(3,4-dimethylphenyl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C20H28N3S+ MolecularWeight: 342.52142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3S/c1-16-10-11-19(14-17(16)2)21-20(24)23(13-12-22(3)4)15-18-8-6-5-7-9-18/h5-11,14H,12-13,15H2,1-4H3,(H,21,24)/p+1