N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-butyl-3-fluoranyl-benzamide

Systemtic Name: N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-butyl-3-fluoranyl-benzamide Openeye Name: N-[1-[3-(4-bromophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-butyl-3-fluoro-benzamide CAS Name: N-[1-[3-(4-bromophenyl)-4-oxo-2-quinazolinyl]ethyl]-N-butyl-3-fluorobenzamide IUPAC Name: N-[1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]ethyl]-N-butyl-3-fluorobenzamide Traditional Name: N-[1-[3-(4-bromophenyl)-4-keto-quinazolin-2-yl]ethyl]-N-butyl-3-fluoro-benzamide Formula: C27H25BrFN3O2 MolecularWeight: 522.408703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H25BrFN3O2/c1-3-4-16-31(26(33)19-8-7-9-21(29)17-19)18(2)25-30-24-11-6-5-10-23(24)27(34)32(25)22-14-12-20(28)13-15-22/h5-15,17-18H,3-4,16H2,1-2H3