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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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