N-tert-butyl-4-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzamide

Systemtic Name: N-tert-butyl-4-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzamide Openeye Name: N-tert-butyl-4-[[2-(6-fluoro-4-oxo-quinazolin-3-yl)acetyl]amino]benzamide CAS Name: N-tert-butyl-4-[[2-(6-fluoro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]benzamide IUPAC Name: N-tert-butyl-4-[[2-(6-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]benzamide Traditional Name: N-tert-butyl-4-[[2-(6-fluoro-4-keto-quinazolin-3-yl)acetyl]amino]benzamide Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3/c1-21(2,3)25-19(28)13-4-7-15(8-5-13)24-18(27)11-26-12-23-17-9-6-14(22)10-16(17)20(26)29/h4-10,12H,11H2,1-3H3,(H,24,27)(H,25,28)