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

Systemtic Name: N-(3,4-dimethoxyphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Openeye Name: N-(3,4-dimethoxyphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide CAS Name: N-(3,4-dimethoxyphenyl)-4-[[5-(3-fluorophenyl)-2-pyrimidinyl]amino]benzamide IUPAC Name: N-(3,4-dimethoxyphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Traditional Name: N-(3,4-dimethoxyphenyl)-4-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide Formula: C25H21FN4O3 MolecularWeight: 444.457643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC(=CC=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC(=CC=C4)F)OC

InChI

InChI=1S/C25H21FN4O3/c1-32-22-11-10-21(13-23(22)33-2)29-24(31)16-6-8-20(9-7-16)30-25-27-14-18(15-28-25)17-4-3-5-19(26)12-17/h3-15H,1-2H3,(H,29,31)(H,27,28,30)