2-methylpropyl 5-methyl-4-oxidanylidene-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 5-methyl-4-oxidanylidene-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=C(S2)C(=O)OCC(C)C)C)C(=O)N1

Isomeric SMILES

CCCC1=NC2=C(C(=C(S2)C(=O)OCC(C)C)C)C(=O)N1

InChI

InChI=1S/C15H20N2O3S/c1-5-6-10-16-13(18)11-9(4)12(21-14(11)17-10)15(19)20-7-8(2)3/h8H,5-7H2,1-4H3,(H,16,17,18)