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

Systemtic Name: dimethyl-[2-[(3-methylsulfanylphenyl)carbamothioyl-(1-pyridin-2-ylethyl)amino]ethyl]azanium Openeye Name: dimethyl-[2-[(3-methylsulfanylphenyl)carbamothioyl-[1-(2-pyridyl)ethyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[[3-(methylthio)anilino]-sulfanylidenemethyl]-[1-(2-pyridinyl)ethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(3-methylsulfanylphenyl)carbamothioyl-(1-pyridin-2-ylethyl)amino]ethyl]azanium Traditional Name: dimethyl-[2-[[3-(methylthio)phenyl]thiocarbamoyl-[1-(2-pyridyl)ethyl]amino]ethyl]ammonium Formula: C19H27N4S2+ MolecularWeight: 375.57448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)N(CC[NH+](C)C)C(=S)NC2=CC(=CC=C2)SC

Isomeric SMILES

CC(C1=CC=CC=N1)N(CC[NH+](C)C)C(=S)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C19H26N4S2/c1-15(18-10-5-6-11-20-18)23(13-12-22(2)3)19(24)21-16-8-7-9-17(14-16)25-4/h5-11,14-15H,12-13H2,1-4H3,(H,21,24)/p+1