3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[(2-phenylethanoylamino)methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanamide

Systemtic Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[(2-phenylethanoylamino)methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanamide Openeye Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[[(2-phenylacetyl)amino]methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanamide CAS Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[[(1-oxo-2-phenylethyl)amino]methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]-2-pyrimidinyl]amino]propanamide IUPAC Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[[(2-phenylacetyl)amino]methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propanamide Traditional Name: 3-[[4-[4-(4-fluorophenyl)-2-[5-methyl-5-[[(2-phenylacetyl)amino]methyl]-1,3-dioxan-2-yl]-1H-imidazol-5-yl]pyrimidin-2-yl]amino]propionamide Formula: C30H32FN7O4 MolecularWeight: 573.617983

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)N)C4=CC=C(C=C4)F)CNC(=O)CC5=CC=CC=C5

Isomeric SMILES

CC1(COC(OC1)C2=NC(=C(N2)C3=NC(=NC=C3)NCCC(=O)N)C4=CC=C(C=C4)F)CNC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C30H32FN7O4/c1-30(16-35-24(40)15-19-5-3-2-4-6-19)17-41-28(42-18-30)27-37-25(20-7-9-21(31)10-8-20)26(38-27)22-11-13-33-29(36-22)34-14-12-23(32)39/h2-11,13,28H,12,14-18H2,1H3,(H2,32,39)(H,35,40)(H,37,38)(H,33,34,36)