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

Systemtic Name: ethyl 4-azanyl-5-methyl-2-(2-phenoxyethanoyloxymethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[(2-phenoxyacetyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[(1-oxo-2-phenoxyethoxy)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[(2-phenoxyacetyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[(2-phenoxyacetyl)oxymethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O5S/c1-3-25-19(24)16-11(2)15-17(20)21-13(22-18(15)28-16)9-27-14(23)10-26-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H2,20,21,22)