N-butyl-N-[1-[7-chloranyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-2-fluoranyl-benzamide

Systemtic Name: N-butyl-N-[1-[7-chloranyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-2-fluoranyl-benzamide Openeye Name: N-butyl-N-[1-[7-chloro-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-2-fluoro-benzamide CAS Name: N-butyl-N-[1-[7-chloro-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-2-fluorobenzamide IUPAC Name: N-butyl-N-[1-[7-chloro-3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-2-fluorobenzamide Traditional Name: N-butyl-N-[1-[7-chloro-4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]ethyl]-2-fluoro-benzamide Formula: C28H27ClFN3O3 MolecularWeight: 507.983683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCCCN(C(C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C28H27ClFN3O3/c1-4-5-16-32(27(34)22-8-6-7-9-24(22)30)18(2)26-31-25-17-19(29)10-15-23(25)28(35)33(26)20-11-13-21(36-3)14-12-20/h6-15,17-18H,4-5,16H2,1-3H3