[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NCCC2=CC=CS2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NCCC2=CC=CS2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c25-19(22-11-8-18-7-4-14-29-18)15-28-20(26)16-9-12-24(13-10-16)21(27)23-17-5-2-1-3-6-17/h1-7,14,16H,8-13,15H2,(H,22,25)(H,23,27)