N-(3-ethyl-2-morpholin-4-yl-pentyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C22H36N4O4S MolecularWeight: 452.61064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2)N3CCOCC3

InChI

InChI=1S/C22H36N4O4S/c1-3-18(4-2)21(25-12-14-30-15-13-25)17-24-22(27)19-7-10-26(11-8-19)31(28,29)20-6-5-9-23-16-20/h5-6,9,16,18-19,21H,3-4,7-8,10-15,17H2,1-2H3,(H,24,27)