2-(1-adamantylcarbamothioylamino)ethyl-diethyl-azanium chloride

Systemtic Name: 2-(1-adamantylcarbamothioylamino)ethyl-diethyl-azanium chloride Openeye Name: 2-(1-adamantylcarbamothioylamino)ethyl-diethyl-ammonium chloride CAS Name: 2-[[(1-adamantylamino)-sulfanylidenemethyl]amino]ethyl-diethylammonium chloride IUPAC Name: 2-(1-adamantylcarbamothioylamino)ethyl-diethylazanium chloride Traditional Name: 2-(1-adamantylthiocarbamoylamino)ethyl-diethyl-ammonium chloride Formula: C17H32ClN3S MolecularWeight: 345.97408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=S)NC12CC3CC(C1)CC(C3)C2.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCNC(=S)NC12CC3CC(C1)CC(C3)C2.[Cl-]

InChI

InChI=1S/C17H31N3S.ClH/c1-3-20(4-2)6-5-18-16(21)19-17-10-13-7-14(11-17)9-15(8-13)12-17;/h13-15H,3-12H2,1-2H3,(H2,18,19,21);1H