1-(5-cyanopyridin-2-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-2-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(5-cyano-2-pyridyl)-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridinyl)-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-2-yl)-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)isonipecotamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H31N5O4S/c1-2-34-22-8-7-21(16-23(22)35(32,33)30-12-4-3-5-13-30)28-25(31)20-10-14-29(15-11-20)24-9-6-19(17-26)18-27-24/h6-9,16,18,20H,2-5,10-15H2,1H3,(H,28,31)