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

Systemtic Name: tert-butyl [3-[2-cyclopropyl-4-methyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[2-cyclopropyl-4-methyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[2-cyclopropyl-4-methyl-6-(1-methyl-2-benzimidazolyl)-1-benzimidazolyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[2-cyclopropyl-4-methyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[2-cyclopropyl-4-methyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C37H36N4O3 MolecularWeight: 584.70674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=NC4=CC=CC=C4N3C)N(C(=N2)C5CC5)C6=C(C(=C(C=C6)C7=CC=CC=C7)OC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=NC4=CC=CC=C4N3C)N(C(=N2)C5CC5)C6=C(C(=C(C=C6)C7=CC=CC=C7)OC(=O)OC(C)(C)C)C

InChI

InChI=1S/C37H36N4O3/c1-22-20-26(34-38-28-14-10-11-15-30(28)40(34)6)21-31-32(22)39-35(25-16-17-25)41(31)29-19-18-27(24-12-8-7-9-13-24)33(23(29)2)43-36(42)44-37(3,4)5/h7-15,18-21,25H,16-17H2,1-6H3