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

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]acetic acid CAS Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylthio]acetic acid IUPAC Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(4,6-diamino-s-triazin-2-yl)methylthio]acetic acid Formula: C6H9N5O2S MolecularWeight: 215.23296

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=NC(=NC(=N1)N)N)SCC(=O)O

Isomeric SMILES

C(C1=NC(=NC(=N1)N)N)SCC(=O)O

InChI

InChI=1S/C6H9N5O2S/c7-5-9-3(10-6(8)11-5)1-14-2-4(12)13/h1-2H2,(H,12,13)(H4,7,8,9,10,11)