[5-[[2-butyl-6-(propanoylamino)benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(phenylsulfonyl)carbamate

Systemtic Name: [5-[[2-butyl-6-(propanoylamino)benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(phenylsulfonyl)carbamate Openeye Name: [5-[[2-butyl-6-(propanoylamino)benzimidazol-1-yl]methyl]-2-phenyl-phenyl] N-(benzenesulfonyl)carbamate CAS Name: N-(benzenesulfonyl)carbamic acid [5-[[2-butyl-6-(1-oxopropylamino)-1-benzimidazolyl]methyl]-2-phenylphenyl] ester IUPAC Name: [5-[[2-butyl-6-(propanoylamino)benzimidazol-1-yl]methyl]-2-phenylphenyl] N-(benzenesulfonyl)carbamate Traditional Name: N-besylcarbamic acid [5-[(2-butyl-6-propionamido-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] ester Formula: C34H34N4O5S MolecularWeight: 610.72256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C5=CC=CC=C5)C=C(C=C2)NC(=O)CC

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C5=CC=CC=C5)C=C(C=C2)NC(=O)CC

InChI

InChI=1S/C34H34N4O5S/c1-3-5-16-32-36-29-20-18-26(35-33(39)4-2)22-30(29)38(32)23-24-17-19-28(25-12-8-6-9-13-25)31(21-24)43-34(40)37-44(41,42)27-14-10-7-11-15-27/h6-15,17-22H,3-5,16,23H2,1-2H3,(H,35,39)(H,37,40)