5-methyl-4-oxidanylidene-3-pentyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-4-oxidanylidene-3-pentyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-oxo-3-pentyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-pentyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-4-oxo-3-pentylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-amyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C13H15N2O3S- MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C13H16N2O3S/c1-3-4-5-6-15-7-14-11-9(12(15)16)8(2)10(19-11)13(17)18/h7H,3-6H2,1-2H3,(H,17,18)/p-1