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

Systemtic Name: [5-[(5-acetamido-2-butyl-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] N-(trifluoromethylsulfonyl)carbamate Openeye Name: [5-[(5-acetamido-2-butyl-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] N-(trifluoromethylsulfonyl)carbamate CAS Name: N-(trifluoromethylsulfonyl)carbamic acid [5-[(5-acetamido-2-butyl-1-benzimidazolyl)methyl]-2-phenylphenyl] ester IUPAC Name: [5-[(5-acetamido-2-butylbenzimidazol-1-yl)methyl]-2-phenylphenyl] N-(trifluoromethylsulfonyl)carbamate Traditional Name: N-triflylcarbamic acid [5-[(5-acetamido-2-butyl-benzimidazol-1-yl)methyl]-2-phenyl-phenyl] ester Formula: C28H27F3N4O5S MolecularWeight: 588.59799

Click to see the large picture

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=CC(=C2)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C28H27F3N4O5S/c1-3-4-10-26-33-23-16-21(32-18(2)36)12-14-24(23)35(26)17-19-11-13-22(20-8-6-5-7-9-20)25(15-19)40-27(37)34-41(38,39)28(29,30)31/h5-9,11-16H,3-4,10,17H2,1-2H3,(H,32,36)(H,34,37)