ethyl 5-methyl-4-oxidanylidene-2-[(1R)-1-pentanoyloxyethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-[(1R)-1-pentanoyloxyethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-[(1R)-1-pentanoyloxyethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[(1R)-1-(1-oxopentoxy)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-[(1R)-1-pentanoyloxyethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(1R)-1-valeryloxyethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C)C1=NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N1

Isomeric SMILES

CCCCC(=O)O[C@H](C)C1=NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N1

InChI

InChI=1S/C17H22N2O5S/c1-5-7-8-11(20)24-10(4)14-18-15(21)12-9(3)13(17(22)23-6-2)25-16(12)19-14/h10H,5-8H2,1-4H3,(H,18,19,21)/t10-/m1/s1