tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)imidazol-4-yl]-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)imidazol-4-yl]-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)imidazol-4-yl]-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)-4-imidazolyl]-4-methyl-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)imidazol-4-yl]-4-methylbenzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[2-cyclopropyl-6-[1-(2-methoxyethyl)imidazol-4-yl]-4-methyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C35H38N4O4 MolecularWeight: 578.70062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=CN(C=N3)CCOC)N(C(=N2)C4CC4)C5=C(C(=C(C=C5)C6=CC=CC=C6)OC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=CN(C=N3)CCOC)N(C(=N2)C4CC4)C5=C(C(=C(C=C5)C6=CC=CC=C6)OC(=O)OC(C)(C)C)C

InChI

InChI=1S/C35H38N4O4/c1-22-18-26(28-20-38(21-36-28)16-17-41-6)19-30-31(22)37-33(25-12-13-25)39(30)29-15-14-27(24-10-8-7-9-11-24)32(23(29)2)42-34(40)43-35(3,4)5/h7-11,14-15,18-21,25H,12-13,16-17H2,1-6H3