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

Systemtic Name: 2-[[4-[(1-methylimidazol-2-yl)carbonylamino]-2-phenyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[4-[(1-methylimidazole-2-carbonyl)amino]-2-phenyl-benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[4-[[(1-methyl-2-imidazolyl)-oxomethyl]amino]-2-phenylphenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[4-[(1-methylimidazole-2-carbonyl)amino]-2-phenylbenzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[4-[(1-methylimidazole-2-carbonyl)amino]-2-phenyl-benzoyl]amino]-4-(methylthio)butyric acid Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)NC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1C(=O)NC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H24N4O4S/c1-27-12-11-24-20(27)22(29)25-16-8-9-17(18(14-16)15-6-4-3-5-7-15)21(28)26-19(23(30)31)10-13-32-2/h3-9,11-12,14,19H,10,13H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)