ethyl 4-(butan-2-ylcarbamothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(butan-2-ylcarbamothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(sec-butylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[(butan-2-ylamino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(butan-2-ylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(sec-butylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C12H23N3O2S MolecularWeight: 273.39492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N1CCN(CC1)C(=O)OCC

Isomeric SMILES

CCC(C)NC(=S)N1CCN(CC1)C(=O)OCC

InChI

InChI=1S/C12H23N3O2S/c1-4-10(3)13-11(18)14-6-8-15(9-7-14)12(16)17-5-2/h10H,4-9H2,1-3H3,(H,13,18)