(2E)-5-(1-benzofuran-2-yl)-2-(5-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one

Systemtic Name: (2E)-5-(1-benzofuran-2-yl)-2-(5-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one Openeye Name: (2E)-5-(benzofuran-2-yl)-2-(5-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one CAS Name: (2E)-5-(2-benzofuranyl)-2-(5-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one IUPAC Name: (2E)-5-(1-benzofuran-2-yl)-2-(5-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one Traditional Name: (2E)-5-(benzofuran-2-yl)-2-(5-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)-6-methyl-3-phenethyl-1H-pyrimidin-4-one Formula: C27H21FN2O3 MolecularWeight: 440.465643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C2C=CC=C(C2=O)F)N1)CCC3=CC=CC=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C(=O)N(/C(=C/2\C=CC=C(C2=O)F)/N1)CCC3=CC=CC=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H21FN2O3/c1-17-24(23-16-19-10-5-6-13-22(19)33-23)27(32)30(15-14-18-8-3-2-4-9-18)26(29-17)20-11-7-12-21(28)25(20)31/h2-13,16,29H,14-15H2,1H3/b26-20+