N-(3-acetamido-5-oxidanylidene-1,4-dihydropyrazol-4-yl)-4-fluoranyl-benzamide

Systemtic Name: N-(3-acetamido-5-oxidanylidene-1,4-dihydropyrazol-4-yl)-4-fluoranyl-benzamide Openeye Name: N-(3-acetamido-5-oxo-1,4-dihydropyrazol-4-yl)-4-fluoro-benzamide CAS Name: N-(3-acetamido-5-oxo-1,4-dihydropyrazol-4-yl)-4-fluorobenzamide IUPAC Name: N-(3-acetamido-5-oxo-1,4-dihydropyrazol-4-yl)-4-fluorobenzamide Traditional Name: N-(3-acetamido-5-keto-2-pyrazolin-4-yl)-4-fluoro-benzamide Formula: C12H11FN4O3 MolecularWeight: 278.239143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NNC(=O)C1NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)NC1=NNC(=O)C1NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H11FN4O3/c1-6(18)14-10-9(12(20)17-16-10)15-11(19)7-2-4-8(13)5-3-7/h2-5,9H,1H3,(H,15,19)(H,17,20)(H,14,16,18)