ethyl 1-[2-(4-methoxyphenyl)ethanoylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-methoxyphenyl)ethanoylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[2-(4-methoxyphenyl)acetyl]carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[2-(4-methoxyphenyl)acetyl]carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[[2-(4-methoxyphenyl)acetyl]thiocarbamoyl]isonipecotic acid ethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H24N2O4S/c1-3-24-17(22)14-8-10-20(11-9-14)18(25)19-16(21)12-13-4-6-15(23-2)7-5-13/h4-7,14H,3,8-12H2,1-2H3,(H,19,21,25)