(2E)-2-[3,5-bis(bromanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: (2E)-2-[3,5-bis(bromanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: (2E)-2-(3,5-dibromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one CAS Name: (2E)-2-(3,5-dibromo-6-oxo-1-cyclohexa-2,4-dienylidene)-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: (2E)-2-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: (2E)-2-(3,5-dibromo-6-keto-cyclohexa-2,4-dien-1-ylidene)-5-ethyl-3-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-pyrimidin-4-one Formula: C21H19Br2FN2O2 MolecularWeight: 510.194163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C2C=C(C=C(C2=O)Br)Br)N(C1=O)CCC3=CC(=CC=C3)F)C

Isomeric SMILES

CCC1=C(N/C(=C\2/C=C(C=C(C2=O)Br)Br)/N(C1=O)CCC3=CC(=CC=C3)F)C

InChI

InChI=1S/C21H19Br2FN2O2/c1-3-16-12(2)25-20(17-10-14(22)11-18(23)19(17)27)26(21(16)28)8-7-13-5-4-6-15(24)9-13/h4-6,9-11,25H,3,7-8H2,1-2H3/b20-17+