N-tert-butyl-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-tert-butyl-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-tert-butyl-N-[2-(4-fluoroanilino)-2-oxo-ethyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-tert-butyl-N-[2-(4-fluoroanilino)-2-oxoethyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-tert-butyl-N-[2-(4-fluoroanilino)-2-oxoethyl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-tert-butyl-N-[2-(4-fluoroanilino)-2-keto-ethyl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C22H23FN4O3 MolecularWeight: 410.441423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC(=O)NC1=CC=C(C=C1)F)C(=O)CN2C3=CC=CC=C3C(=O)C=N2

Isomeric SMILES

CC(C)(C)N(CC(=O)NC1=CC=C(C=C1)F)C(=O)CN2C3=CC=CC=C3C(=O)C=N2

InChI

InChI=1S/C22H23FN4O3/c1-22(2,3)26(13-20(29)25-16-10-8-15(23)9-11-16)21(30)14-27-18-7-5-4-6-17(18)19(28)12-24-27/h4-12H,13-14H2,1-3H3,(H,25,29)