ethyl 4-azanyl-2-[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[2-(5,6-dimethyl-3-benzofuranyl)-1-oxoethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CC3=COC4=CC(=C(C=C43)C)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)CC3=COC4=CC(=C(C=C43)C)C)N)C

InChI

InChI=1S/C23H23N3O5S/c1-5-29-23(28)20-13(4)19-21(24)25-17(26-22(19)32-20)10-31-18(27)8-14-9-30-16-7-12(3)11(2)6-15(14)16/h6-7,9H,5,8,10H2,1-4H3,(H2,24,25,26)