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

Systemtic Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-fluoranyl-benzamide Openeye Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-3-fluoro-benzamide CAS Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-fluorobenzamide IUPAC Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-fluorobenzamide Traditional Name: N-butyl-3-fluoro-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]benzamide Formula: C29H30FN3O3 MolecularWeight: 487.565203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30FN3O3/c1-4-6-18-32(28(34)21-10-9-11-22(30)19-21)20(3)27-31-26-13-8-7-12-25(26)29(35)33(27)23-14-16-24(17-15-23)36-5-2/h7-17,19-20H,4-6,18H2,1-3H3