tert-butyl [2-[[2-butyl-6-(cyclohexylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[2-butyl-6-(cyclohexylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(cyclohexylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-(cyclohexylamino)-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(cyclohexylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(cyclohexylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C35H43N3O3 MolecularWeight: 553.73422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NC5CCCCC5

InChI

InChI=1S/C35H43N3O3/c1-5-6-20-32-37-30-22-21-28(36-27-17-11-8-12-18-27)23-31(30)38(32)24-26-16-13-19-29(25-14-9-7-10-15-25)33(26)40-34(39)41-35(2,3)4/h7,9-10,13-16,19,21-23,27,36H,5-6,8,11-12,17-18,20,24H2,1-4H3