2-[[(1S)-1-(1-adamantyl)ethyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(1S)-1-(1-adamantyl)ethyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(1S)-1-(1-adamantyl)ethyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(1S)-1-(1-adamantyl)ethyl]amino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(1S)-1-(1-adamantyl)ethyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[(1S)-1-(1-adamantyl)ethyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H32N3S+ MolecularWeight: 310.52108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NCC[NH+](C)C

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C17H31N3S/c1-12(19-16(21)18-4-5-20(2)3)17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15H,4-11H2,1-3H3,(H2,18,19,21)/p+1/t12-,13?,14?,15?,17?/m0/s1