5-methyl-3-(2-methylpropyl)-2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-3-(2-methylpropyl)-2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-isobutyl-5-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-(2-methylpropyl)-2,4-dioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 5-methyl-3-(2-methylpropyl)-2,4-dioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-isobutyl-2,4-diketo-5-methyl-1H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C12H13N2O4S- MolecularWeight: 281.30762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=O)N2)CC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=O)N2)CC(C)C)C(=O)[O-]

InChI

InChI=1S/C12H14N2O4S/c1-5(2)4-14-10(15)7-6(3)8(11(16)17)19-9(7)13-12(14)18/h5H,4H2,1-3H3,(H,13,18)(H,16,17)/p-1