ethanedioic acid; 2-ethoxy-N-(2-morpholin-4-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

Systemtic Name: ethanedioic acid; 2-ethoxy-N-(2-morpholin-4-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-ethoxy-N-(2-morpholinosulfonylethyl)-N-(4-pyridylmethyl)pyridine-3-carboxamide; oxalic acid CAS Name: 2-ethoxy-N-[2-(4-morpholinylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)-3-pyridinecarboxamide; oxalic acid IUPAC Name: 2-ethoxy-N-(2-morpholin-4-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide; oxalic acid Traditional Name: 2-ethoxy-N-(2-morpholinosulfonylethyl)-N-(4-pyridylmethyl)nicotinamide; oxalic acid Formula: C22H28N4O9S MolecularWeight: 524.54412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N(CCS(=O)(=O)N2CCOCC2)CC3=CC=NC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N(CCS(=O)(=O)N2CCOCC2)CC3=CC=NC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N4O5S.C2H2O4/c1-2-29-19-18(4-3-7-22-19)20(25)23(16-17-5-8-21-9-6-17)12-15-30(26,27)24-10-13-28-14-11-24;3-1(4)2(5)6/h3-9H,2,10-16H2,1H3;(H,3,4)(H,5,6)