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

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-oxo-2-(phenethylamino)ethyl]thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-(phenethylamino)ethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-(phenethylamino)ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O3S/c1-12-10-15(20-23-12)19-17(22)13(2)24-11-16(21)18-9-8-14-6-4-3-5-7-14/h3-7,10,13H,8-9,11H2,1-2H3,(H,18,21)(H,19,20,22)