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

Systemtic Name: 2-[[2-(1-adamantyl)ethanoylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[[2-(1-adamantyl)acetyl]amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[2-(1-adamantyl)acetyl]amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[[2-(1-adamantyl)acetyl]amino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H31N4OS+ MolecularWeight: 339.51924

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NNC(=O)CC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C[NH+](C)CCNC(=S)NNC(=O)CC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C17H30N4OS/c1-21(2)4-3-18-16(23)20-19-15(22)11-17-8-12-5-13(9-17)7-14(6-12)10-17/h12-14H,3-11H2,1-2H3,(H,19,22)(H2,18,20,23)/p+1