2-[2-(4,6-dimethyl-2-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(4,6-dimethyl-2-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(2-keto-4,6-dimethyl-1H-pyrimidin-5-yl)acetyl]amino]-3-methyl-butyric acid Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)C)CC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)C)CC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C13H19N3O4/c1-6(2)11(12(18)19)16-10(17)5-9-7(3)14-13(20)15-8(9)4/h6,11H,5H2,1-4H3,(H,16,17)(H,18,19)(H,14,15,20)