2-[[4-(1H-imidazol-5-ylmethylamino)-2-phenyl-phenyl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-(1H-imidazol-5-ylmethylamino)-2-phenyl-phenyl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-(1H-imidazol-5-ylmethylamino)-2-phenyl-benzoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[4-(1H-imidazol-5-ylmethylamino)-2-phenylphenyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-(1H-imidazol-5-ylmethylamino)-2-phenylbenzoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[4-(1H-imidazol-5-ylmethylamino)-2-phenyl-benzoyl]amino]-4-methyl-valeric acid Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1=C(C=C(C=C1)NCC2=CN=CN2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1=C(C=C(C=C1)NCC2=CN=CN2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N4O3/c1-15(2)10-21(23(29)30)27-22(28)19-9-8-17(25-13-18-12-24-14-26-18)11-20(19)16-6-4-3-5-7-16/h3-9,11-12,14-15,21,25H,10,13H2,1-2H3,(H,24,26)(H,27,28)(H,29,30)