N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide

Systemtic Name: N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Openeye Name: N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide CAS Name: N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)-2-pyrimidinyl]amino]benzamide IUPAC Name: N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Traditional Name: N-(4-ethylphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Formula: C25H21FN4O MolecularWeight: 412.458843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC(=CC=C4)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H21FN4O/c1-2-17-6-10-22(11-7-17)29-24(31)18-8-12-23(13-9-18)30-25-27-15-20(16-28-25)19-4-3-5-21(26)14-19/h3-16H,2H2,1H3,(H,29,31)(H,27,28,30)