2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4,6-dimorpholino-1,3,5-triazin-2-yl)sulfanyl]acetic acid CAS Name: 2-[[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]thio]acetic acid IUPAC Name: 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4,6-dimorpholino-s-triazin-2-yl)thio]acetic acid Formula: C13H19N5O4S MolecularWeight: 341.38606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)SCC(=O)O)N3CCOCC3

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)SCC(=O)O)N3CCOCC3

InChI

InChI=1S/C13H19N5O4S/c19-10(20)9-23-13-15-11(17-1-5-21-6-2-17)14-12(16-13)18-3-7-22-8-4-18/h1-9H2,(H,19,20)