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

Systemtic Name: ethyl 4-azanyl-2-[2-(4-ethylphenoxy)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[2-(4-ethylphenoxy)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[2-(4-ethylphenoxy)-1-oxoethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[2-(4-ethylphenoxy)acetyl]oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[2-(4-ethylphenoxy)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)OCC2=NC(=C3C(=C(SC3=N2)C(=O)OCC)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)OCC2=NC(=C3C(=C(SC3=N2)C(=O)OCC)C)N

InChI

InChI=1S/C21H23N3O5S/c1-4-13-6-8-14(9-7-13)28-11-16(25)29-10-15-23-19(22)17-12(3)18(21(26)27-5-2)30-20(17)24-15/h6-9H,4-5,10-11H2,1-3H3,(H2,22,23,24)