3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoranyl-pyrazol-4-yl]-1,1-diethyl-urea

Systemtic Name: 3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoranyl-pyrazol-4-yl]-1,1-diethyl-urea Openeye Name: 3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoro-pyrazol-4-yl]-1,1-diethyl-urea CAS Name: 3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoro-4-pyrazolyl]-1,1-diethylurea IUPAC Name: 3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoropyrazol-4-yl]-1,1-diethylurea Traditional Name: 3-[1-(6-ethoxy-1H-benzimidazol-2-yl)-5-fluoro-pyrazol-4-yl]-1,1-diethyl-urea Formula: C17H21FN6O2 MolecularWeight: 360.386043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC1=C(N(N=C1)C2=NC3=C(N2)C=C(C=C3)OCC)F

Isomeric SMILES

CCN(CC)C(=O)NC1=C(N(N=C1)C2=NC3=C(N2)C=C(C=C3)OCC)F

InChI

InChI=1S/C17H21FN6O2/c1-4-23(5-2)17(25)22-14-10-19-24(15(14)18)16-20-12-8-7-11(26-6-3)9-13(12)21-16/h7-10H,4-6H2,1-3H3,(H,20,21)(H,22,25)