[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: [2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid [2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1CCN(CC1)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1CCN(CC1)C(=O)C2=CC=CS2

InChI

InChI=1S/C21H32N2O4S/c1-20(2,3)14-21(4,5)22-17(24)13-27-19(26)15-8-10-23(11-9-15)18(25)16-7-6-12-28-16/h6-7,12,15H,8-11,13-14H2,1-5H3,(H,22,24)