ethyl 1-[(4-methoxyphenyl)carbonylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-methoxyphenyl)carbonylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-methoxybenzoyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methoxybenzoyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-(p-anisoylthiocarbamoyl)isonipecotic acid ethyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O4S/c1-3-23-16(21)13-8-10-19(11-9-13)17(24)18-15(20)12-4-6-14(22-2)7-5-12/h4-7,13H,3,8-11H2,1-2H3,(H,18,20,24)