(2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-yl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-yl]carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridine-2-carbonyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[[3-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-2-pyridinyl]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridine-2-carbonyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypicolinoyl]amino]-3-methyl-butyric acid Formula: C17H20N4O6 MolecularWeight: 376.3639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=C(C=CC=N1)OC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1=C(C=CC=N1)OC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C17H20N4O6/c1-9(2)13(16(23)24)21-15(22)14-10(6-5-7-18-14)27-17-19-11(25-3)8-12(20-17)26-4/h5-9,13H,1-4H3,(H,21,22)(H,23,24)/t13-/m0/s1