4-azanyl-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 4-azanyl-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-amino-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-amino-2-[(2-ethoxy-2-oxoethyl)thio]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-amino-2-(2-ethoxy-2-oxoethyl)sulfanyl-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-amino-2-[(2-ethoxy-2-keto-ethyl)thio]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C12H13N3O4S2 MolecularWeight: 327.37932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=C2C(=C(SC2=N1)C(=O)O)C)N

Isomeric SMILES

CCOC(=O)CSC1=NC(=C2C(=C(SC2=N1)C(=O)O)C)N

InChI

InChI=1S/C12H13N3O4S2/c1-3-19-6(16)4-20-12-14-9(13)7-5(2)8(11(17)18)21-10(7)15-12/h3-4H2,1-2H3,(H,17,18)(H2,13,14,15)