2-methyl-2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]butanoic acid

Systemtic Name: 2-methyl-2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]butanoic acid Openeye Name: 2-methyl-2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]butanoic acid CAS Name: 2-methyl-2-[[oxo-(2-pyridin-4-yl-3H-benzimidazol-5-yl)methyl]amino]butanoic acid IUPAC Name: 2-methyl-2-[(2-pyridin-4-yl-3H-benzimidazole-5-carbonyl)amino]butanoic acid Traditional Name: 2-methyl-2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]butyric acid Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)NC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=NC=C3

Isomeric SMILES

CCC(C)(C(=O)O)NC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=NC=C3

InChI

InChI=1S/C18H18N4O3/c1-3-18(2,17(24)25)22-16(23)12-4-5-13-14(10-12)21-15(20-13)11-6-8-19-9-7-11/h4-10H,3H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)