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

Systemtic Name: N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-fluoranyl-N-phenethyl-benzamide Openeye Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-3-fluoro-N-phenethyl-benzamide CAS Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-3-fluoro-N-phenethylbenzamide IUPAC Name: N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]propyl]-3-fluoro-N-phenethylbenzamide Traditional Name: 3-fluoro-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)propyl]-N-phenethyl-benzamide Formula: C34H32FN3O3 MolecularWeight: 549.634583

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)F

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C34H32FN3O3/c1-3-31(37(22-21-24-11-6-5-7-12-24)33(39)25-13-10-14-26(35)23-25)32-36-30-16-9-8-15-29(30)34(40)38(32)27-17-19-28(20-18-27)41-4-2/h5-20,23,31H,3-4,21-22H2,1-2H3