3-methyl-2-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[2-[methyl(2-pyrimidinyl)amino]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]pentanoic acid Traditional Name: 3-methyl-2-[[2-[methyl(2-pyrimidyl)amino]acetyl]amino]valeric acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CN(C)C1=NC=CC=N1

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CN(C)C1=NC=CC=N1

InChI

InChI=1S/C13H20N4O3/c1-4-9(2)11(12(19)20)16-10(18)8-17(3)13-14-6-5-7-15-13/h5-7,9,11H,4,8H2,1-3H3,(H,16,18)(H,19,20)