dimethyl-[2-[(4-methylphenyl)carbamothioyl-(1-pyridin-3-ylethyl)amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[(4-methylphenyl)carbamothioyl-(1-pyridin-3-ylethyl)amino]ethyl]azanium Openeye Name: dimethyl-[2-[p-tolylcarbamothioyl-[1-(3-pyridyl)ethyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[(4-methylanilino)-sulfanylidenemethyl]-[1-(3-pyridinyl)ethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(4-methylphenyl)carbamothioyl-(1-pyridin-3-ylethyl)amino]ethyl]azanium Traditional Name: dimethyl-[2-[p-tolylthiocarbamoyl-[1-(3-pyridyl)ethyl]amino]ethyl]ammonium Formula: C19H27N4S+ MolecularWeight: 343.50948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4S/c1-15-7-9-18(10-8-15)21-19(24)23(13-12-22(3)4)16(2)17-6-5-11-20-14-17/h5-11,14,16H,12-13H2,1-4H3,(H,21,24)/p+1