2-[2-[(3-acetamido-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[(3-acetamido-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(3-acetamido-4-fluoro-anilino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(3-acetamido-4-fluoroanilino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(3-acetamido-4-fluoroanilino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(3-acetamido-4-fluoro-anilino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C17H19FN4O4S MolecularWeight: 394.420563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19FN4O4S/c1-9-6-15(22-26-9)21-17(25)10(2)27-8-16(24)20-12-4-5-13(18)14(7-12)19-11(3)23/h4-7,10H,8H2,1-3H3,(H,19,23)(H,20,24)(H,21,22,25)