tert-butyl 4-[2-(phenylmethylsulfanyl)ethylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(phenylmethylsulfanyl)ethylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-(2-benzylsulfanylethylcarbamoyl)piperidine-1-carboxylate CAS Name: 4-[oxo-[2-(phenylmethylthio)ethylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-benzylsulfanylethylcarbamoyl)piperidine-1-carboxylate Traditional Name: 4-[2-(benzylthio)ethylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C20H30N2O3S/c1-20(2,3)25-19(24)22-12-9-17(10-13-22)18(23)21-11-14-26-15-16-7-5-4-6-8-16/h4-8,17H,9-15H2,1-3H3,(H,21,23)