methyl 2-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-5-ethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 2-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-5-ethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(4-ethoxycarbonyl-1-piperidyl)methyl]-5-ethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(4-ethoxycarbonyl-1-piperidinyl)methyl]-5-ethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-5-ethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(4-carbethoxypiperidino)methyl]-5-ethyl-4-keto-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)NC(=N2)CN3CCC(CC3)C(=O)OCC)C(=O)OC

Isomeric SMILES

CCC1=C(SC2=C1C(=O)NC(=N2)CN3CCC(CC3)C(=O)OCC)C(=O)OC

InChI

InChI=1S/C19H25N3O5S/c1-4-12-14-16(23)20-13(21-17(14)28-15(12)19(25)26-3)10-22-8-6-11(7-9-22)18(24)27-5-2/h11H,4-10H2,1-3H3,(H,20,21,23)