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

Systemtic Name: tert-butyl [2-[[2-butyl-5-[methyl(propanoyl)amino]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-5-[methyl(propanoyl)amino]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-5-[methyl(1-oxopropyl)amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-5-[methyl(propanoyl)amino]benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-5-[methyl(propionyl)amino]benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C33H39N3O4 MolecularWeight: 541.68046

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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)N(C)C(=O)CC

Isomeric SMILES

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

InChI

InChI=1S/C33H39N3O4/c1-7-9-18-29-34-27-21-25(35(6)30(37)8-2)19-20-28(27)36(29)22-24-16-13-17-26(23-14-11-10-12-15-23)31(24)39-32(38)40-33(3,4)5/h10-17,19-21H,7-9,18,22H2,1-6H3