ethyl 1-(3-phenylpropanoylcarbamothioyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-phenylpropanoylcarbamothioyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3-phenylpropanoylcarbamothioyl)piperidine-4-carboxylate CAS Name: 1-[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-phenylpropanoylcarbamothioyl)piperidine-4-carboxylate Traditional Name: 1-(hydrocinnamoylthiocarbamoyl)isonipecotic acid ethyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O3S/c1-2-23-17(22)15-10-12-20(13-11-15)18(24)19-16(21)9-8-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3,(H,19,21,24)