[5-[(2-butyl-5,6-dimethoxy-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] N-(trifluoromethylsulfonyl)carbamate

Systemtic Name: [5-[(2-butyl-5,6-dimethoxy-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] N-(trifluoromethylsulfonyl)carbamate Openeye Name: [5-[(2-butyl-5,6-dimethoxy-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] N-(trifluoromethylsulfonyl)carbamate CAS Name: N-(trifluoromethylsulfonyl)carbamic acid [5-[(2-butyl-5,6-dimethoxy-1-benzimidazolyl)methyl]-2-phenylphenyl] ester IUPAC Name: [5-[(2-butyl-5,6-dimethoxybenzimidazol-1-yl)methyl]-2-phenylphenyl] N-(trifluoromethylsulfonyl)carbamate Traditional Name: N-triflylcarbamic acid [5-[(2-butyl-5,6-dimethoxy-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] ester Formula: C28H28F3N3O6S MolecularWeight: 591.59863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=C(C=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C(F)(F)F)OC)OC

Isomeric SMILES

CCCCC1=NC2=CC(=C(C=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)NS(=O)(=O)C(F)(F)F)OC)OC

InChI

InChI=1S/C28H28F3N3O6S/c1-4-5-11-26-32-21-15-24(38-2)25(39-3)16-22(21)34(26)17-18-12-13-20(19-9-7-6-8-10-19)23(14-18)40-27(35)33-41(36,37)28(29,30)31/h6-10,12-16H,4-5,11,17H2,1-3H3,(H,33,35)