ethyl 4-(1-adamantylcarbonylcarbamothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(1-adamantylcarbonylcarbamothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(adamantane-1-carbonylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[[[1-adamantyl(oxo)methyl]amino]-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(adamantane-1-carbonylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(adamantane-1-carbonylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H29N3O3S/c1-2-25-18(24)22-5-3-21(4-6-22)17(26)20-16(23)19-10-13-7-14(11-19)9-15(8-13)12-19/h13-15H,2-12H2,1H3,(H,20,23,26)