N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(1-methylene-3-oxo-isoindolin-2-yl)acetamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-2-(1-methylene-3-oxo-2-isoindolyl)acetamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-2-(1-methylidene-3-oxoisoindol-2-yl)acetamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(1-keto-3-methylene-isoindolin-2-yl)acetamide Formula: C22H17FN4O3S MolecularWeight: 436.458783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=C)C4=CC=CC=C4C3=O)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=C)C4=CC=CC=C4C3=O)F

InChI

InChI=1S/C22H17FN4O3S/c1-12-15-5-3-4-6-16(15)21(30)27(12)10-20(29)26-22-25-19(11-31-22)17-8-7-14(9-18(17)23)24-13(2)28/h3-9,11H,1,10H2,2H3,(H,24,28)(H,25,26,29)