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

Systemtic Name: 2-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(3-iodoanilino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(3-iodoanilino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(3-iodoanilino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(3-iodoanilino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C15H16IN3O3S MolecularWeight: 445.27531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C15H16IN3O3S/c1-9-6-13(19-22-9)18-15(21)10(2)23-8-14(20)17-12-5-3-4-11(16)7-12/h3-7,10H,8H2,1-2H3,(H,17,20)(H,18,19,21)