3-[(E)-2-[3-(2-chloranylpyridin-3-yl)-6-fluoranyl-4-oxidanylidene-quinazolin-2-yl]ethenyl]benzaldehyde

Systemtic Name: 3-[(E)-2-[3-(2-chloranylpyridin-3-yl)-6-fluoranyl-4-oxidanylidene-quinazolin-2-yl]ethenyl]benzaldehyde Openeye Name: 3-[(E)-2-[3-(2-chloro-3-pyridyl)-6-fluoro-4-oxo-quinazolin-2-yl]vinyl]benzaldehyde CAS Name: 3-[(E)-2-[3-(2-chloro-3-pyridinyl)-6-fluoro-4-oxo-2-quinazolinyl]ethenyl]benzaldehyde IUPAC Name: 3-[(E)-2-[3-(2-chloropyridin-3-yl)-6-fluoro-4-oxoquinazolin-2-yl]ethenyl]benzaldehyde Traditional Name: 3-[(E)-2-[3-(2-chloro-3-pyridyl)-6-fluoro-4-keto-quinazolin-2-yl]vinyl]benzaldehyde Formula: C22H13ClFN3O2 MolecularWeight: 405.808923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=O)C=CC2=NC3=C(C=C(C=C3)F)C(=O)N2C4=C(N=CC=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)C=O)/C=C/C2=NC3=C(C=C(C=C3)F)C(=O)N2C4=C(N=CC=C4)Cl

InChI

InChI=1S/C22H13ClFN3O2/c23-21-19(5-2-10-25-21)27-20(9-6-14-3-1-4-15(11-14)13-28)26-18-8-7-16(24)12-17(18)22(27)29/h1-13H/b9-6+