5-methyl-1-(2-methylpropyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-2-carboxylic acid

Systemtic Name: 5-methyl-1-(2-methylpropyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-2-carboxylic acid Openeye Name: 1-isobutyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-2-carboxylic acid CAS Name: 5-methyl-1-(2-methylpropyl)-4-oxo-2-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-1-(2-methylpropyl)-4-oxothieno[2,3-d]pyrimidine-2-carboxylic acid Traditional Name: 1-isobutyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-2-carboxylic acid Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C(=O)N=C(N2CC(C)C)C(=O)O

Isomeric SMILES

CC1=CSC2=C1C(=O)N=C(N2CC(C)C)C(=O)O

InChI

InChI=1S/C12H14N2O3S/c1-6(2)4-14-9(12(16)17)13-10(15)8-7(3)5-18-11(8)14/h5-6H,4H2,1-3H3,(H,16,17)