N3-cyclooctyl-N5-(3-methylbutyl)-4-oxidanylidene-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N3-cyclooctyl-N5-(3-methylbutyl)-4-oxidanylidene-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide Openeye Name: N3-cyclooctyl-N5-isopentyl-4-oxo-1-[2-(2-pyridyl)ethyl]pyridine-3,5-dicarboxamide CAS Name: N3-cyclooctyl-N5-(3-methylbutyl)-4-oxo-1-[2-(2-pyridinyl)ethyl]pyridine-3,5-dicarboxamide IUPAC Name: 3-N-cyclooctyl-5-N-(3-methylbutyl)-4-oxo-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide Traditional Name: N-cyclooctyl-N'-isoamyl-4-keto-1-[2-(2-pyridyl)ethyl]dinicotinamide Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CCC3=CC=CC=N3

Isomeric SMILES

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CCC3=CC=CC=N3

InChI

InChI=1S/C27H38N4O3/c1-20(2)13-16-29-26(33)23-18-31(17-14-21-10-8-9-15-28-21)19-24(25(23)32)27(34)30-22-11-6-4-3-5-7-12-22/h8-10,15,18-20,22H,3-7,11-14,16-17H2,1-2H3,(H,29,33)(H,30,34)