3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanoic acid

Systemtic Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanoic acid Openeye Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanoic acid CAS Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]-2-pyrimidinyl]amino]propanoic acid IUPAC Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanoic acid Traditional Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-(methylcarbamoyl)-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propionic acid Formula: C23H25FN6O5 MolecularWeight: 484.480203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=NC(=C(N2)C3=NC(=NC=C3)NCCC(=O)O)C4=CC=C(C=C4)F)C(=O)NC

Isomeric SMILES

CC1(COC(OC1)C2=NC(=C(N2)C3=NC(=NC=C3)NCCC(=O)O)C4=CC=C(C=C4)F)C(=O)NC

InChI

InChI=1S/C23H25FN6O5/c1-23(21(33)25-2)11-34-20(35-12-23)19-29-17(13-3-5-14(24)6-4-13)18(30-19)15-7-9-26-22(28-15)27-10-8-16(31)32/h3-7,9,20H,8,10-12H2,1-2H3,(H,25,33)(H,29,30)(H,31,32)(H,26,27,28)