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

Systemtic Name: ethyl 4-[5-methyl-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-methyl-3-(2-morpholino-2-oxo-ethyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-methyl-3-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)-4-oxothieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-keto-3-(2-keto-2-morpholino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H27N5O6S MolecularWeight: 477.53398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCOCC4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCOCC4)C

InChI

InChI=1S/C21H27N5O6S/c1-3-32-21(30)25-6-4-24(5-7-25)20(29)17-14(2)16-18(33-17)22-13-26(19(16)28)12-15(27)23-8-10-31-11-9-23/h13H,3-12H2,1-2H3