2,4-bis(methylsulfonyl)pyrimidine-5-sulfonic acid

Systemtic Name: 2,4-bis(methylsulfonyl)pyrimidine-5-sulfonic acid Openeye Name: 2,4-bis(methylsulfonyl)pyrimidine-5-sulfonic acid CAS Name: 2,4-bis(methylsulfonyl)-5-pyrimidinesulfonic acid IUPAC Name: 2,4-bis(methylsulfonyl)pyrimidine-5-sulfonic acid Traditional Name: 2,4-dimesylpyrimidine-5-sulfonic acid Formula: C6H8N2O7S3 MolecularWeight: 316.33192

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC(=NC=C1S(=O)(=O)O)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=NC(=NC=C1S(=O)(=O)O)S(=O)(=O)C

InChI

InChI=1S/C6H8N2O7S3/c1-16(9,10)5-4(18(13,14)15)3-7-6(8-5)17(2,11)12/h3H,1-2H3,(H,13,14,15)