2-methoxyethyl 5-methyl-4-oxidanylidene-3-[(4-propoxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methoxyethyl 5-methyl-4-oxidanylidene-3-[(4-propoxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-methoxyethyl 5-methyl-4-oxo-3-[(4-propoxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[[4-[oxo(propoxy)methyl]phenyl]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-methyl-4-oxo-3-[(4-propoxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(4-propoxycarbonylbenzyl)thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCCOC)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCCOC)C

InChI

InChI=1S/C22H24N2O6S/c1-4-9-29-21(26)16-7-5-15(6-8-16)12-24-13-23-19-17(20(24)25)14(2)18(31-19)22(27)30-11-10-28-3/h5-8,13H,4,9-12H2,1-3H3