ethyl 1-[5-methyl-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-methyl-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-methyl-3-(2-morpholino-2-oxo-ethyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-methyl-3-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)-4-oxothieno[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[4-keto-3-(2-keto-2-morpholino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]isonipecotic acid ethyl ester Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCOCC4)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCOCC4)C

InChI

InChI=1S/C22H28N4O6S/c1-3-32-22(30)15-4-6-25(7-5-15)21(29)18-14(2)17-19(33-18)23-13-26(20(17)28)12-16(27)24-8-10-31-11-9-24/h13,15H,3-12H2,1-2H3