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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(2-cyclohexylethanoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-[(2-cyclohexylacetyl)amino]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-[(2-cyclohexyl-1-oxoethyl)amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-[(2-cyclohexylacetyl)amino]benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-[(2-cyclohexylacetyl)amino]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C37H45N3O4 MolecularWeight: 595.7709

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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)NC(=O)CC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NC(=O)CC5CCCCC5

InChI

InChI=1S/C37H45N3O4/c1-5-6-20-33-39-31-22-21-29(38-34(41)23-26-14-9-7-10-15-26)24-32(31)40(33)25-28-18-13-19-30(27-16-11-8-12-17-27)35(28)43-36(42)44-37(2,3)4/h8,11-13,16-19,21-22,24,26H,5-7,9-10,14-15,20,23,25H2,1-4H3,(H,38,41)