(E)-3-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-pyrimidin-5-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-pyrimidin-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-fluorophenyl)-6-isopropyl-2-phenyl-pyrimidin-5-yl]prop-2-enoic acid CAS Name: (E)-3-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-ylpyrimidin-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-fluorophenyl)-6-isopropyl-2-phenyl-pyrimidin-5-yl]acrylic acid Formula: C22H19FN2O2 MolecularWeight: 362.396863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1C=CC(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NC(=NC(=C1/C=C/C(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C22H19FN2O2/c1-14(2)20-18(12-13-19(26)27)21(15-8-10-17(23)11-9-15)25-22(24-20)16-6-4-3-5-7-16/h3-14H,1-2H3,(H,26,27)/b13-12+