1-[6-[5-(dimethylamino)pyridin-3-yl]-4-(3-fluoranylpyridin-2-yl)-1H-benzimidazol-2-yl]-3-ethyl-urea

Systemtic Name: 1-[6-[5-(dimethylamino)pyridin-3-yl]-4-(3-fluoranylpyridin-2-yl)-1H-benzimidazol-2-yl]-3-ethyl-urea Openeye Name: 1-[6-[5-(dimethylamino)-3-pyridyl]-4-(3-fluoro-2-pyridyl)-1H-benzimidazol-2-yl]-3-ethyl-urea CAS Name: 1-[6-[5-(dimethylamino)-3-pyridinyl]-4-(3-fluoro-2-pyridinyl)-1H-benzimidazol-2-yl]-3-ethylurea IUPAC Name: 1-[6-[5-(dimethylamino)pyridin-3-yl]-4-(3-fluoropyridin-2-yl)-1H-benzimidazol-2-yl]-3-ethylurea Traditional Name: 1-[6-[5-(dimethylamino)-3-pyridyl]-4-(3-fluoro-2-pyridyl)-1H-benzimidazol-2-yl]-3-ethyl-urea Formula: C22H22FN7O MolecularWeight: 419.454783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22FN7O/c1-4-25-22(31)29-21-27-18-10-13(14-8-15(30(2)3)12-24-11-14)9-16(20(18)28-21)19-17(23)6-5-7-26-19/h5-12H,4H2,1-3H3,(H3,25,27,28,29,31)