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

Systemtic Name: methyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(3-propoxycarbonylphenyl)amino]ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-methyl-4-oxo-3-[2-oxo-2-(3-propoxycarbonylanilino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-[3-[oxo(propoxy)methyl]anilino]ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-oxo-3-[2-oxo-2-(3-propoxycarbonylanilino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(3-propoxycarbonylanilino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O6S/c1-4-8-30-20(27)13-6-5-7-14(9-13)23-15(25)10-24-11-22-18-16(19(24)26)12(2)17(31-18)21(28)29-3/h5-7,9,11H,4,8,10H2,1-3H3,(H,23,25)