N-cyclooctyl-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-cyclooctyl-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Openeye Name: N-cyclooctyl-1-[6-(1-piperidylsulfonyl)-2-quinolyl]piperidine-3-carboxamide CAS Name: N-cyclooctyl-1-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-3-piperidinecarboxamide IUPAC Name: N-cyclooctyl-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Traditional Name: N-cyclooctyl-1-(6-piperidinosulfonyl-2-quinolyl)nipecotamide Formula: C28H40N4O3S MolecularWeight: 512.7072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C28H40N4O3S/c33-28(29-24-11-5-2-1-3-6-12-24)23-10-9-17-31(21-23)27-16-13-22-20-25(14-15-26(22)30-27)36(34,35)32-18-7-4-8-19-32/h13-16,20,23-24H,1-12,17-19,21H2,(H,29,33)