2-[[4-[carboxy-(1-methylimidazol-2-yl)amino]-2-phenyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[4-[carboxy-(1-methylimidazol-2-yl)amino]-2-phenyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[4-[carboxy-(1-methylimidazol-2-yl)amino]-2-phenyl-benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[4-[carboxy-(1-methyl-2-imidazolyl)amino]-2-phenylphenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[4-[carboxy-(1-methylimidazol-2-yl)amino]-2-phenylbenzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[4-[carboxy-(1-methylimidazol-2-yl)amino]-2-phenyl-benzoyl]amino]-4-(methylthio)butyric acid Formula: C23H24N4O5S MolecularWeight: 468.52546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1N(C2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1C=CN=C1N(C2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H24N4O5S/c1-26-12-11-24-22(26)27(23(31)32)16-8-9-17(18(14-16)15-6-4-3-5-7-15)20(28)25-19(21(29)30)10-13-33-2/h3-9,11-12,14,19H,10,13H2,1-2H3,(H,25,28)(H,29,30)(H,31,32)