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

Systemtic Name: (2R)-2-[[4-[(1H-imidazol-5-ylmethylamino)methyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: (2R)-2-[[4-[(1H-imidazol-5-ylmethylamino)methyl]-2-(o-tolyl)benzoyl]amino]-4-methyl-pentanoic acid CAS Name: (2R)-2-[[[4-[(1H-imidazol-5-ylmethylamino)methyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: (2R)-2-[[4-[(1H-imidazol-5-ylmethylamino)methyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylpentanoic acid Traditional Name: (2R)-2-[[4-[(1H-imidazol-5-ylmethylamino)methyl]-2-(o-tolyl)benzoyl]amino]-4-methyl-valeric acid Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)CNCC3=CN=CN3)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)CNCC3=CN=CN3)C(=O)N[C@H](CC(C)C)C(=O)O

InChI

InChI=1S/C25H30N4O3/c1-16(2)10-23(25(31)32)29-24(30)21-9-8-18(12-26-13-19-14-27-15-28-19)11-22(21)20-7-5-4-6-17(20)3/h4-9,11,14-16,23,26H,10,12-13H2,1-3H3,(H,27,28)(H,29,30)(H,31,32)/t23-/m1/s1