3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(3-fluorophenyl)methyl]benzamide

Systemtic Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(3-fluorophenyl)methyl]benzamide Openeye Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(3-fluorophenyl)methyl]benzamide CAS Name: 3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]-N-[(3-fluorophenyl)methyl]benzamide IUPAC Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(3-fluorophenyl)methyl]benzamide Traditional Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(3-fluorobenzyl)benzamide Formula: C26H22FN5O2 MolecularWeight: 455.483583

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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)C(=O)NCC4=CC(=CC=C4)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)NCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H22FN5O2/c1-17(33)30-22-10-8-19(9-11-22)24-12-13-28-26(32-24)31-23-7-3-5-20(15-23)25(34)29-16-18-4-2-6-21(27)14-18/h2-15H,16H2,1H3,(H,29,34)(H,30,33)(H,28,31,32)