4-[[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl]amino]butanoic acid Openeye Name: 4-[[2-oxo-2-(pyrimidin-2-ylamino)ethyl]amino]butanoic acid CAS Name: 4-[[2-oxo-2-(2-pyrimidinylamino)ethyl]amino]butanoic acid IUPAC Name: 4-[[2-oxo-2-(pyrimidin-2-ylamino)ethyl]amino]butanoic acid Traditional Name: 4-[[2-keto-2-(2-pyrimidylamino)ethyl]amino]butyric acid Formula: C10H14N4O3 MolecularWeight: 238.24316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)CNCCCC(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)CNCCCC(=O)O

InChI

InChI=1S/C10H14N4O3/c15-8(7-11-4-1-3-9(16)17)14-10-12-5-2-6-13-10/h2,5-6,11H,1,3-4,7H2,(H,16,17)(H,12,13,14,15)