N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-fluoranyl-N-(phenylmethyl)benzamide

Systemtic Name: N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-fluoranyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-3-fluoro-benzamide CAS Name: N-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]propyl]-3-fluoro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]propyl]-3-fluorobenzamide Traditional Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]propyl]-3-fluoro-benzamide Formula: C33H30FN3O2 MolecularWeight: 519.608603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C)N(CC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)F

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C)N(CC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C33H30FN3O2/c1-4-30(36(21-24-11-6-5-7-12-24)32(38)25-13-10-14-26(34)20-25)31-35-29-16-9-8-15-28(29)33(39)37(31)27-18-17-22(2)23(3)19-27/h5-20,30H,4,21H2,1-3H3