N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-(2-pyridin-2-ylethylamino)ethyl]sulfanyl-propanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-(2-pyridin-2-ylethylamino)ethyl]sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-oxo-2-[2-(2-pyridyl)ethylamino]ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-oxo-2-[2-(2-pyridinyl)ethylamino]ethyl]thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-(2-pyridin-2-ylethylamino)ethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-[2-(2-pyridyl)ethylamino]ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCC2=CC=CC=N2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCC2=CC=CC=N2

InChI

InChI=1S/C16H20N4O3S/c1-11-9-14(20-23-11)19-16(22)12(2)24-10-15(21)18-8-6-13-5-3-4-7-17-13/h3-5,7,9,12H,6,8,10H2,1-2H3,(H,18,21)(H,19,20,22)