3-[3-[[[3-(1H-benzimidazol-2-ylamino)phenyl]carbonylamino]methyl]phenyl]butanoic acid

Systemtic Name: 3-[3-[[[3-(1H-benzimidazol-2-ylamino)phenyl]carbonylamino]methyl]phenyl]butanoic acid Openeye Name: 3-[3-[[[3-(1H-benzimidazol-2-ylamino)benzoyl]amino]methyl]phenyl]butanoic acid CAS Name: 3-[3-[[[[3-(1H-benzimidazol-2-ylamino)phenyl]-oxomethyl]amino]methyl]phenyl]butanoic acid IUPAC Name: 3-[3-[[[3-(1H-benzimidazol-2-ylamino)benzoyl]amino]methyl]phenyl]butanoic acid Traditional Name: 3-[3-[[[3-(1H-benzimidazol-2-ylamino)benzoyl]amino]methyl]phenyl]butyric acid Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(CC(=O)O)C1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C25H24N4O3/c1-16(12-23(30)31)18-7-4-6-17(13-18)15-26-24(32)19-8-5-9-20(14-19)27-25-28-21-10-2-3-11-22(21)29-25/h2-11,13-14,16H,12,15H2,1H3,(H,26,32)(H,30,31)(H2,27,28,29)