[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-fluoranylbenzoate

Systemtic Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-fluoranylbenzoate Openeye Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C24H18FN3O2 MolecularWeight: 399.417023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C24H18FN3O2/c1-16-26-22(17-6-3-2-4-7-17)15-23(27-16)28-20-8-5-9-21(14-20)30-24(29)18-10-12-19(25)13-11-18/h2-15H,1H3,(H,26,27,28)