2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]propanoic acid Openeye Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylthio]propanoic acid IUPAC Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(4,6-diamino-s-triazin-2-yl)methylthio]propionic acid Formula: C7H11N5O2S MolecularWeight: 229.25954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=NC(=NC(=N1)N)N

Isomeric SMILES

CC(C(=O)O)SCC1=NC(=NC(=N1)N)N

InChI

InChI=1S/C7H11N5O2S/c1-3(5(13)14)15-2-4-10-6(8)12-7(9)11-4/h3H,2H2,1H3,(H,13,14)(H4,8,9,10,11,12)