tert-butyl [2-[[2-butyl-5-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-[[2-butyl-5-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-5-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-5-[[(cyclohexylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-5-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-5-(cyclohexylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C36H44N4O4 MolecularWeight: 596.75896

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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=CC(=C2)NC(=O)NC5CCCCC5

Isomeric SMILES

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

InChI

InChI=1S/C36H44N4O4/c1-5-6-20-32-39-30-23-28(38-34(41)37-27-17-11-8-12-18-27)21-22-31(30)40(32)24-26-16-13-19-29(25-14-9-7-10-15-25)33(26)43-35(42)44-36(2,3)4/h7,9-10,13-16,19,21-23,27H,5-6,8,11-12,17-18,20,24H2,1-4H3,(H2,37,38,41)