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

Systemtic Name: ethyl 4-azanyl-2-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyloxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[2-(4-chloro-3-methyl-phenoxy)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[2-(4-chloro-3-methylphenoxy)-1-oxoethoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[2-(4-chloro-3-methylphenoxy)acetyl]oxymethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[2-(4-chloro-3-methyl-phenoxy)acetyl]oxymethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)COC3=CC(=C(C=C3)Cl)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)COC3=CC(=C(C=C3)Cl)C)N)C

InChI

InChI=1S/C20H20ClN3O5S/c1-4-27-20(26)17-11(3)16-18(22)23-14(24-19(16)30-17)8-29-15(25)9-28-12-5-6-13(21)10(2)7-12/h5-7H,4,8-9H2,1-3H3,(H2,22,23,24)