2-[(2-ethyl-6-methyl-phenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-ethyl-6-methyl-phenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-ethyl-6-methyl-phenyl)carbamothioyl-(2-thienylmethyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-ethyl-6-methylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl-(2-thenyl)amino]ethyl-dimethyl-ammonium Formula: C19H28N3S2+ MolecularWeight: 362.57572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N(CC[NH+](C)C)CC2=CC=CS2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N(CC[NH+](C)C)CC2=CC=CS2)C

InChI

InChI=1S/C19H27N3S2/c1-5-16-9-6-8-15(2)18(16)20-19(23)22(12-11-21(3)4)14-17-10-7-13-24-17/h6-10,13H,5,11-12,14H2,1-4H3,(H,20,23)/p+1