3-[[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]methyl]benzamide

Systemtic Name: 3-[[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]methyl]benzamide Openeye Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]methyl]benzamide CAS Name: 3-[[5-(2-amino-4-pyrimidinyl)-4-(4-fluorophenyl)-1-imidazolyl]methyl]benzamide IUPAC Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]methyl]benzamide Traditional Name: 3-[[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]methyl]benzamide Formula: C21H17FN6O MolecularWeight: 388.397683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=NC(=C2C3=NC(=NC=C3)N)C4=CC=C(C=C4)F)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=NC(=C2C3=NC(=NC=C3)N)C4=CC=C(C=C4)F)C(=O)N

InChI

InChI=1S/C21H17FN6O/c22-16-6-4-14(5-7-16)18-19(17-8-9-25-21(24)27-17)28(12-26-18)11-13-2-1-3-15(10-13)20(23)29/h1-10,12H,11H2,(H2,23,29)(H2,24,25,27)