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

Systemtic Name: ethyl 4-azanyl-2-(1-benzofuran-2-ylcarbonyloxymethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-(benzofuran-2-carbonyloxymethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[2-benzofuranyl(oxo)methoxy]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(1-benzofuran-2-carbonyloxymethyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-(benzofuran-2-carbonyloxymethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CC4=CC=CC=C4O3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)COC(=O)C3=CC4=CC=CC=C4O3)N)C

InChI

InChI=1S/C20H17N3O5S/c1-3-26-20(25)16-10(2)15-17(21)22-14(23-18(15)29-16)9-27-19(24)13-8-11-6-4-5-7-12(11)28-13/h4-8H,3,9H2,1-2H3,(H2,21,22,23)