3-phenyl-3-[5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzimidazol-1-yl]propanoic acid

Systemtic Name: 3-phenyl-3-[5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzimidazol-1-yl]propanoic acid Openeye Name: 3-phenyl-3-[5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzimidazol-1-yl]propanoic acid CAS Name: 3-[5-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzimidazol-1-yl]propanoic acid Traditional Name: 3-phenyl-3-[5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzimidazol-1-yl]propionic acid Formula: C24H19F3N4O3 MolecularWeight: 468.42787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H19F3N4O3/c25-24(26,27)16-6-8-17(9-7-16)29-23(34)30-18-10-11-20-19(12-18)28-14-31(20)21(13-22(32)33)15-4-2-1-3-5-15/h1-12,14,21H,13H2,(H,32,33)(H2,29,30,34)