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

Systemtic Name: tert-butyl [2-[[2-butyl-6-(oxan-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-[[2-butyl-6-(tetrahydropyran-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-[[2-butyl-6-[[(2-oxanylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-[[2-butyl-6-(oxan-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-[[2-butyl-6-(tetrahydropyran-2-ylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C35H42N4O5 MolecularWeight: 598.73178

Click to see the large picture

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)NC5CCCCO5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C=C(C=C2)NC(=O)NC5CCCCO5

InChI

InChI=1S/C35H42N4O5/c1-5-6-17-30-37-28-20-19-26(36-33(40)38-31-18-10-11-21-42-31)22-29(28)39(30)23-25-15-12-16-27(24-13-8-7-9-14-24)32(25)43-34(41)44-35(2,3)4/h7-9,12-16,19-20,22,31H,5-6,10-11,17-18,21,23H2,1-4H3,(H2,36,38,40)