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

Systemtic Name: N3-cyclooctyl-N5-(2-methylsulfanylethyl)-4-oxidanylidene-1-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide Openeye Name: N3-cyclooctyl-N5-(2-methylsulfanylethyl)-4-oxo-1-(2-pyridylmethyl)pyridine-3,5-dicarboxamide CAS Name: N3-cyclooctyl-N5-[2-(methylthio)ethyl]-4-oxo-1-(2-pyridinylmethyl)pyridine-3,5-dicarboxamide IUPAC Name: 3-N-cyclooctyl-5-N-(2-methylsulfanylethyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide Traditional Name: N-cyclooctyl-4-keto-N'-[2-(methylthio)ethyl]-1-(2-pyridylmethyl)dinicotinamide Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CC3=CC=CC=N3

Isomeric SMILES

CSCCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CC3=CC=CC=N3

InChI

InChI=1S/C24H32N4O3S/c1-32-14-13-26-23(30)20-16-28(15-19-11-7-8-12-25-19)17-21(22(20)29)24(31)27-18-9-5-3-2-4-6-10-18/h7-8,11-12,16-18H,2-6,9-10,13-15H2,1H3,(H,26,30)(H,27,31)