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

Systemtic Name: 2-[[4,6-bis(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4,6-bis(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]sulfanyl]acetic acid CAS Name: 2-[[4,6-bis(carboxymethylthio)-1,3,5-triazin-2-yl]thio]acetic acid IUPAC Name: 2-[[4,6-bis(carboxymethylsulfanyl)-1,3,5-triazin-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4,6-bis(carboxymethylthio)-s-triazin-2-yl]thio]acetic acid Formula: C9H9N3O6S3 MolecularWeight: 351.37926

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)SC1=NC(=NC(=N1)SCC(=O)O)SCC(=O)O

Isomeric SMILES

C(C(=O)O)SC1=NC(=NC(=N1)SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C9H9N3O6S3/c13-4(14)1-19-7-10-8(20-2-5(15)16)12-9(11-7)21-3-6(17)18/h1-3H2,(H,13,14)(H,15,16)(H,17,18)