[2-[[2-butyl-6-(5-oxidanylpentylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ethyl carbonate

Systemtic Name: [2-[[2-butyl-6-(5-oxidanylpentylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ethyl carbonate Openeye Name: [2-[[2-butyl-6-(5-hydroxypentylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ethyl carbonate CAS Name: carbonic acid [2-[[2-butyl-6-[[(5-hydroxypentylamino)-oxomethyl]amino]-1-benzimidazolyl]methyl]-6-phenylphenyl] ethyl ester IUPAC Name: [2-[[2-butyl-6-(5-hydroxypentylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenylphenyl] ethyl carbonate Traditional Name: carbonic acid [2-[[2-butyl-6-(5-hydroxypentylcarbamoylamino)benzimidazol-1-yl]methyl]-6-phenyl-phenyl] ethyl ester Formula: C33H40N4O5 MolecularWeight: 572.6945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H40N4O5/c1-3-5-17-30-36-28-19-18-26(35-32(39)34-20-10-7-11-21-38)22-29(28)37(30)23-25-15-12-16-27(24-13-8-6-9-14-24)31(25)42-33(40)41-4-2/h6,8-9,12-16,18-19,22,38H,3-5,7,10-11,17,20-21,23H2,1-2H3,(H2,34,35,39)