ethyl N-[2-butyl-3-[[4-phenyl-3-(trifluoromethylsulfonylcarbamoyloxy)phenyl]methyl]benzimidazol-5-yl]carbamate

Systemtic Name: ethyl N-[2-butyl-3-[[4-phenyl-3-(trifluoromethylsulfonylcarbamoyloxy)phenyl]methyl]benzimidazol-5-yl]carbamate Openeye Name: ethyl N-[2-butyl-3-[[4-phenyl-3-(trifluoromethylsulfonylcarbamoyloxy)phenyl]methyl]benzimidazol-5-yl]carbamate CAS Name: N-[2-butyl-3-[[3-[oxo-(trifluoromethylsulfonylamino)methoxy]-4-phenylphenyl]methyl]-5-benzimidazolyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-butyl-3-[[4-phenyl-3-(trifluoromethylsulfonylcarbamoyloxy)phenyl]methyl]benzimidazol-5-yl]carbamate Traditional Name: N-[2-butyl-3-[4-phenyl-3-(triflylcarbamoyloxy)benzyl]benzimidazol-5-yl]carbamic acid ethyl ester Formula: C29H29F3N4O6S MolecularWeight: 618.62397

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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)C(F)(F)F)C=C(C=C2)NC(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C29H29F3N4O6S/c1-3-5-11-26-34-23-15-13-21(33-27(37)41-4-2)17-24(23)36(26)18-19-12-14-22(20-9-7-6-8-10-20)25(16-19)42-28(38)35-43(39,40)29(30,31)32/h6-10,12-17H,3-5,11,18H2,1-2H3,(H,33,37)(H,35,38)