3-[[4-(diethylamino)phenyl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(diethylamino)phenyl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(diethylamino)phenyl]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(diethylamino)anilino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(diethylamino)phenyl]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[4-(diethylamino)phenyl]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C16H29N4S+ MolecularWeight: 309.49326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4S/c1-5-20(6-2)15-10-8-14(9-11-15)18-16(21)17-12-7-13-19(3)4/h8-11H,5-7,12-13H2,1-4H3,(H2,17,18,21)/p+1