3-(2,4-dimethoxypyrimidin-5-yl)-1-[2-[[6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[2-[[6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one Openeye Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[2-[[6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-1-[2-[[6-(methoxymethyl)-2-(methylthio)-4-pyrimidinyl]oxymethyl]-4-morpholinyl]-2-propen-1-one IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[2-[[6-(methoxymethyl)-2-methylsulfanylpyrimidin-4-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one Traditional Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[2-[[6-(methoxymethyl)-2-(methylthio)pyrimidin-4-yl]oxymethyl]morpholino]prop-2-en-1-one Formula: C21H27N5O6S MolecularWeight: 477.53398

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=NC(=N1)SC)OCC2CN(CCO2)C(=O)C=CC3=CN=C(N=C3OC)OC

Isomeric SMILES

COCC1=CC(=NC(=N1)SC)OCC2CN(CCO2)C(=O)C=CC3=CN=C(N=C3OC)OC

InChI

InChI=1S/C21H27N5O6S/c1-28-12-15-9-17(24-21(23-15)33-4)32-13-16-11-26(7-8-31-16)18(27)6-5-14-10-22-20(30-3)25-19(14)29-2/h5-6,9-10,16H,7-8,11-13H2,1-4H3