N-cyclooctyl-4-oxidanylidene-1-(2-pyridin-2-ylethyl)-5-thiomorpholin-4-ylcarbonyl-pyridine-3-carboxamide

Systemtic Name: N-cyclooctyl-4-oxidanylidene-1-(2-pyridin-2-ylethyl)-5-thiomorpholin-4-ylcarbonyl-pyridine-3-carboxamide Openeye Name: N-cyclooctyl-4-oxo-1-[2-(2-pyridyl)ethyl]-5-(thiomorpholine-4-carbonyl)pyridine-3-carboxamide CAS Name: N-cyclooctyl-4-oxo-5-[oxo(thiomorpholin-4-yl)methyl]-1-[2-(2-pyridinyl)ethyl]-3-pyridinecarboxamide IUPAC Name: N-cyclooctyl-4-oxo-1-(2-pyridin-2-ylethyl)-5-(thiomorpholine-4-carbonyl)pyridine-3-carboxamide Traditional Name: N-cyclooctyl-4-keto-1-[2-(2-pyridyl)ethyl]-5-(thiomorpholine-4-carbonyl)nicotinamide Formula: C26H34N4O3S MolecularWeight: 482.63816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CN(C=C(C2=O)C(=O)N3CCSCC3)CCC4=CC=CC=N4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CN(C=C(C2=O)C(=O)N3CCSCC3)CCC4=CC=CC=N4

InChI

InChI=1S/C26H34N4O3S/c31-24-22(25(32)28-21-9-4-2-1-3-5-10-21)18-29(13-11-20-8-6-7-12-27-20)19-23(24)26(33)30-14-16-34-17-15-30/h6-8,12,18-19,21H,1-5,9-11,13-17H2,(H,28,32)