(E)-3-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]prop-2-enenitrile

Systemtic Name: (E)-3-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]prop-2-enenitrile Openeye Name: (E)-3-[4,6-bis(4-fluorophenyl)-2-isopropyl-4H-pyrimidin-3-yl]prop-2-enenitrile CAS Name: (E)-3-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]-2-propenenitrile IUPAC Name: (E)-3-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]prop-2-enenitrile Traditional Name: (E)-3-[4,6-bis(4-fluorophenyl)-2-isopropyl-4H-pyrimidin-3-yl]acrylonitrile Formula: C22H19F2N3 MolecularWeight: 363.403166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CC(N1C=CC#N)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=NC(=CC(N1/C=C/C#N)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H19F2N3/c1-15(2)22-26-20(16-4-8-18(23)9-5-16)14-21(27(22)13-3-12-25)17-6-10-19(24)11-7-17/h3-11,13-15,21H,1-2H3/b13-3+