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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(cyclopropylcarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(cyclopropanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-[[cyclopropyl(oxo)methyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(cyclopropanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(cyclopropanecarbonylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C33H37N3O4 MolecularWeight: 539.66458

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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)C5CC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NC(=O)C5CC5

InChI

InChI=1S/C33H37N3O4/c1-5-6-15-29-35-27-19-18-25(34-31(37)23-16-17-23)20-28(27)36(29)21-24-13-10-14-26(22-11-8-7-9-12-22)30(24)39-32(38)40-33(2,3)4/h7-14,18-20,23H,5-6,15-17,21H2,1-4H3,(H,34,37)