ethyl 1-[[3,5-bis(chloranyl)phenyl]carbonylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[3,5-bis(chloranyl)phenyl]carbonylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(3,5-dichlorobenzoyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[(3,5-dichlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3,5-dichlorobenzoyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(3,5-dichlorobenzoyl)thiocarbamoyl]isonipecotic acid ethyl ester Formula: C16H18Cl2N2O3S MolecularWeight: 389.29672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18Cl2N2O3S/c1-2-23-15(22)10-3-5-20(6-4-10)16(24)19-14(21)11-7-12(17)9-13(18)8-11/h7-10H,2-6H2,1H3,(H,19,21,24)