4-(2-hydroxyethylamino)-2-methyl-5-methylsulfanyl-thieno[3,4-d]pyrimidine-7-carboxylic acid

Systemtic Name: 4-(2-hydroxyethylamino)-2-methyl-5-methylsulfanyl-thieno[3,4-d]pyrimidine-7-carboxylic acid Openeye Name: 4-(2-hydroxyethylamino)-2-methyl-5-methylsulfanyl-thieno[3,4-d]pyrimidine-7-carboxylic acid CAS Name: 4-(2-hydroxyethylamino)-2-methyl-5-(methylthio)-7-thieno[3,4-d]pyrimidinecarboxylic acid IUPAC Name: 4-(2-hydroxyethylamino)-2-methyl-5-methylsulfanylthieno[3,4-d]pyrimidine-7-carboxylic acid Traditional Name: 4-(2-hydroxyethylamino)-2-methyl-5-(methylthio)thieno[3,4-d]pyrimidine-7-carboxylic acid Formula: C11H13N3O3S2 MolecularWeight: 299.36922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(SC(=C2C(=N1)NCCO)SC)C(=O)O

Isomeric SMILES

CC1=NC2=C(SC(=C2C(=N1)NCCO)SC)C(=O)O

InChI

InChI=1S/C11H13N3O3S2/c1-5-13-7-6(9(14-5)12-3-4-15)11(18-2)19-8(7)10(16)17/h15H,3-4H2,1-2H3,(H,16,17)(H,12,13,14)