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

Systemtic Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(homoveratrylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C20H23N3O4S/c1-5-27-20(24)17-12(2)16-18(22-11-23-19(16)28-17)21-9-8-13-6-7-14(25-3)15(10-13)26-4/h6-7,10-11H,5,8-9H2,1-4H3,(H,21,22,23)