3-[5-(4-azanylpyrimidin-2-yl)-4-(4-fluorophenyl)imidazol-1-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[5-(4-azanylpyrimidin-2-yl)-4-(4-fluorophenyl)imidazol-1-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[5-(4-aminopyrimidin-2-yl)-4-(4-fluorophenyl)imidazol-1-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[5-(4-amino-2-pyrimidinyl)-4-(4-fluorophenyl)-1-imidazolyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[5-(4-aminopyrimidin-2-yl)-4-(4-fluorophenyl)imidazol-1-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[5-(4-aminopyrimidin-2-yl)-4-(4-fluorophenyl)imidazol-1-yl]-2,2-dimethyl-propionic acid Formula: C18H18FN5O2 MolecularWeight: 355.366223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C=NC(=C1C2=NC=CC(=N2)N)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(C)(CN1C=NC(=C1C2=NC=CC(=N2)N)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C18H18FN5O2/c1-18(2,17(25)26)9-24-10-22-14(11-3-5-12(19)6-4-11)15(24)16-21-8-7-13(20)23-16/h3-8,10H,9H2,1-2H3,(H,25,26)(H2,20,21,23)