4-azanyl-2-methyl-5-methylsulfonyl-thieno[3,4-d]pyrimidine-7-carboxylic acid

Systemtic Name: 4-azanyl-2-methyl-5-methylsulfonyl-thieno[3,4-d]pyrimidine-7-carboxylic acid Openeye Name: 4-amino-2-methyl-5-methylsulfonyl-thieno[3,4-d]pyrimidine-7-carboxylic acid CAS Name: 4-amino-2-methyl-5-methylsulfonyl-7-thieno[3,4-d]pyrimidinecarboxylic acid IUPAC Name: 4-amino-2-methyl-5-methylsulfonylthieno[3,4-d]pyrimidine-7-carboxylic acid Traditional Name: 4-amino-5-mesyl-2-methyl-thieno[3,4-d]pyrimidine-7-carboxylic acid Formula: C9H9N3O4S2 MolecularWeight: 287.31546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(SC(=C2C(=N1)N)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=NC2=C(SC(=C2C(=N1)N)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C9H9N3O4S2/c1-3-11-5-4(7(10)12-3)9(18(2,15)16)17-6(5)8(13)14/h1-2H3,(H,13,14)(H2,10,11,12)