tert-butyl [3-[2-ethyl-6-(5-fluoranyl-1-methyl-benzimidazol-2-yl)-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[2-ethyl-6-(5-fluoranyl-1-methyl-benzimidazol-2-yl)-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[2-ethyl-6-(5-fluoro-1-methyl-benzimidazol-2-yl)-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[2-ethyl-6-(5-fluoro-1-methyl-2-benzimidazolyl)-4-methyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[2-ethyl-6-(5-fluoro-1-methylbenzimidazol-2-yl)-4-methylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[2-ethyl-6-(5-fluoro-1-methyl-benzimidazol-2-yl)-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C36H35FN4O3 MolecularWeight: 590.686503

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C5=NC6=C(N5C)C=CC(=C6)F)C

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C5=NC6=C(N5C)C=CC(=C6)F)C

InChI

InChI=1S/C36H35FN4O3/c1-8-31-39-32-21(2)18-24(34-38-27-20-25(37)14-16-29(27)40(34)7)19-30(32)41(31)28-17-15-26(23-12-10-9-11-13-23)33(22(28)3)43-35(42)44-36(4,5)6/h9-20H,8H2,1-7H3