[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H21N3O4S/c26-20(24-18-6-1-5-17-16(18)4-2-10-23-17)14-29-22(28)15-8-11-25(12-9-15)21(27)19-7-3-13-30-19/h1-7,10,13,15H,8-9,11-12,14H2,(H,24,26)