2-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-3-(3-fluoranyl-4-methyl-phenyl)quinazolin-4-one

Systemtic Name: 2-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-3-(3-fluoranyl-4-methyl-phenyl)quinazolin-4-one Openeye Name: 2-[(E)-2-(2,3-dimethoxyphenyl)vinyl]-3-(3-fluoro-4-methyl-phenyl)quinazolin-4-one CAS Name: 2-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-3-(3-fluoro-4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-3-(3-fluoro-4-methylphenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(2,3-dimethoxyphenyl)vinyl]-3-(3-fluoro-4-methyl-phenyl)quinazolin-4-one Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=C(C(=CC=C4)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=C(C(=CC=C4)OC)OC)F

InChI

InChI=1S/C25H21FN2O3/c1-16-11-13-18(15-20(16)26)28-23(27-21-9-5-4-8-19(21)25(28)29)14-12-17-7-6-10-22(30-2)24(17)31-3/h4-15H,1-3H3/b14-12+