N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-2-fluoranyl-N-hexyl-benzamide

Systemtic Name: N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-2-fluoranyl-N-hexyl-benzamide Openeye Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-2-fluoro-N-hexyl-benzamide CAS Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-2-fluoro-N-hexylbenzamide IUPAC Name: N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]propyl]-2-fluoro-N-hexylbenzamide Traditional Name: 2-fluoro-N-hexyl-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)propyl]benzamide Formula: C32H36FN3O3 MolecularWeight: 529.644943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C32H36FN3O3/c1-4-7-8-13-22-35(31(37)25-14-9-11-16-27(25)33)29(5-2)30-34-28-17-12-10-15-26(28)32(38)36(30)23-18-20-24(21-19-23)39-6-3/h9-12,14-21,29H,4-8,13,22H2,1-3H3