ethyl 4-azanyl-5-methyl-2-[2-(4-propanoylphenoxy)ethanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[2-(4-propanoylphenoxy)ethanoyloxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[[2-(4-propanoylphenoxy)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[1-oxo-2-[4-(1-oxopropyl)phenoxy]ethoxy]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[[2-(4-propanoylphenoxy)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[[2-(4-propionylphenoxy)acetyl]oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)OCC2=NC(=C3C(=C(SC3=N2)C(=O)OCC)C)N

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)OCC2=NC(=C3C(=C(SC3=N2)C(=O)OCC)C)N

InChI

InChI=1S/C22H23N3O6S/c1-4-15(26)13-6-8-14(9-7-13)30-11-17(27)31-10-16-24-20(23)18-12(3)19(22(28)29-5-2)32-21(18)25-16/h6-9H,4-5,10-11H2,1-3H3,(H2,23,24,25)