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

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(1-oxophthalazin-2-yl)acetamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(1-ketophthalazin-2-yl)acetamide Formula: C21H16FN5O3S MolecularWeight: 437.446843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)C4=CC=CC=C4C=N3)F

InChI

InChI=1S/C21H16FN5O3S/c1-12(28)24-14-6-7-16(17(22)8-14)18-11-31-21(25-18)26-19(29)10-27-20(30)15-5-3-2-4-13(15)9-23-27/h2-9,11H,10H2,1H3,(H,24,28)(H,25,26,29)