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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(2-methylpropanoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(2-methylpropanoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-[(2-methyl-1-oxopropyl)amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(2-methylpropanoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(isobutyrylamino)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=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C33H39N3O4/c1-7-8-17-29-35-27-19-18-25(34-31(37)22(2)3)20-28(27)36(29)21-24-15-12-16-26(23-13-10-9-11-14-23)30(24)39-32(38)40-33(4,5)6/h9-16,18-20,22H,7-8,17,21H2,1-6H3,(H,34,37)