2-[[3-(diethylcarbamoyl)phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-(diethylcarbamoyl)phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-(diethylcarbamoyl)phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-[diethylamino(oxo)methyl]anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-(diethylcarbamoyl)phenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[3-(diethylcarbamoyl)phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H27N4OS+ MolecularWeight: 323.47678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCC[NH+](C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C16H26N4OS/c1-5-20(6-2)15(21)13-8-7-9-14(12-13)18-16(22)17-10-11-19(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H2,17,18,22)/p+1