ethyl 4-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[2-(2-oxolanylmethylthio)phenyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(oxolan-2-ylmethylsulfanyl)benzoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(tetrahydrofurfurylthio)benzoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=CC=C2SCC3CCCO3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=CC=C2SCC3CCCO3

InChI

InChI=1S/C20H28N2O4S/c1-2-25-20(24)22-11-9-15(10-12-22)21-19(23)17-7-3-4-8-18(17)27-14-16-6-5-13-26-16/h3-4,7-8,15-16H,2,5-6,9-14H2,1H3,(H,21,23)