1-ethyl-3-[6-[5-fluoranyl-6-(2-oxidanylpropan-2-yl)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[6-[5-fluoranyl-6-(2-oxidanylpropan-2-yl)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Openeye Name: 1-ethyl-3-[6-[5-fluoro-6-(1-hydroxy-1-methyl-ethyl)-3-pyridyl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea CAS Name: 1-ethyl-3-[6-[5-fluoro-6-(2-hydroxypropan-2-yl)-3-pyridinyl]-4-(2-pyrimidinyl)-1H-benzimidazol-2-yl]urea IUPAC Name: 1-ethyl-3-[6-[5-fluoro-6-(2-hydroxypropan-2-yl)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Traditional Name: 1-ethyl-3-[6-[5-fluoro-6-(1-hydroxy-1-methyl-ethyl)-3-pyridyl]-4-(2-pyrimidyl)-1H-benzimidazol-2-yl]urea Formula: C22H22FN7O2 MolecularWeight: 435.454183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=C(N=C3)C(C)(C)O)F)C4=NC=CC=N4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=C(N=C3)C(C)(C)O)F)C4=NC=CC=N4

InChI

InChI=1S/C22H22FN7O2/c1-4-24-21(31)30-20-28-16-10-12(13-9-15(23)18(27-11-13)22(2,3)32)8-14(17(16)29-20)19-25-6-5-7-26-19/h5-11,32H,4H2,1-3H3,(H3,24,28,29,30,31)