N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-3-fluoro-benzamide CAS Name: N-[3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]phenyl]-3-fluorobenzamide IUPAC Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-3-fluorobenzamide Traditional Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-3-fluoro-benzamide Formula: C25H20FN5O2 MolecularWeight: 441.457003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H20FN5O2/c1-16(32)28-20-10-8-17(9-11-20)23-12-13-27-25(31-23)30-22-7-3-6-21(15-22)29-24(33)18-4-2-5-19(26)14-18/h2-15H,1H3,(H,28,32)(H,29,33)(H,27,30,31)