3,3-dimethyl-2-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]butanoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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