ethyl 1-(1-adamantylcarbamothioyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(1-adamantylcarbamothioyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(1-adamantylcarbamothioyl)piperidine-4-carboxylate CAS Name: 1-[(1-adamantylamino)-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-adamantylcarbamothioyl)piperidine-4-carboxylate Traditional Name: 1-(1-adamantylthiocarbamoyl)isonipecotic acid ethyl ester Formula: C19H30N2O2S MolecularWeight: 350.5187

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H30N2O2S/c1-2-23-17(22)16-3-5-21(6-4-16)18(24)20-19-10-13-7-14(11-19)9-15(8-13)12-19/h13-16H,2-12H2,1H3,(H,20,24)