[4-(thiophen-2-ylcarbonylamino)phenyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 1-(5-cyano-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-cyano-2-pyridinyl)-4-piperidinecarboxylic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 1-(5-cyanopyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-cyano-2-pyridyl)isonipecotic acid [4-(2-thenoylamino)phenyl] ester Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4=NC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C23H20N4O3S/c24-14-16-3-8-21(25-15-16)27-11-9-17(10-12-27)23(29)30-19-6-4-18(5-7-19)26-22(28)20-2-1-13-31-20/h1-8,13,15,17H,9-12H2,(H,26,28)