N-(2-cyanoethyl)-2-(2-morpholin-4-ylethylsulfanyl)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: N-(2-cyanoethyl)-2-(2-morpholin-4-ylethylsulfanyl)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Openeye Name: N-(2-cyanoethyl)-2-(2-morpholinoethylsulfanyl)-N-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide CAS Name: N-(2-cyanoethyl)-2-[2-(4-morpholinyl)ethylthio]-N-(2-oxolanylmethyl)-3-pyridinecarboxamide IUPAC Name: N-(2-cyanoethyl)-2-(2-morpholin-4-ylethylsulfanyl)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Traditional Name: N-(2-cyanoethyl)-2-(2-morpholinoethylthio)-N-(tetrahydrofurfuryl)nicotinamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CCC#N)C(=O)C2=C(N=CC=C2)SCCN3CCOCC3

Isomeric SMILES

C1CC(OC1)CN(CCC#N)C(=O)C2=C(N=CC=C2)SCCN3CCOCC3

InChI

InChI=1S/C20H28N4O3S/c21-6-3-8-24(16-17-4-2-12-27-17)20(25)18-5-1-7-22-19(18)28-15-11-23-9-13-26-14-10-23/h1,5,7,17H,2-4,8-16H2