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

Systemtic Name: 1-[2-[[6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]oxymethyl]morpholin-4-yl]-3-pyridin-2-yl-prop-2-en-1-one Openeye Name: 1-[2-[[6-(methoxymethyl)-2-methylsulfanyl-pyrimidin-4-yl]oxymethyl]morpholin-4-yl]-3-(2-pyridyl)prop-2-en-1-one CAS Name: 1-[2-[[6-(methoxymethyl)-2-(methylthio)-4-pyrimidinyl]oxymethyl]-4-morpholinyl]-3-(2-pyridinyl)-2-propen-1-one IUPAC Name: 1-[2-[[6-(methoxymethyl)-2-methylsulfanylpyrimidin-4-yl]oxymethyl]morpholin-4-yl]-3-pyridin-2-ylprop-2-en-1-one Traditional Name: 1-[2-[[6-(methoxymethyl)-2-(methylthio)pyrimidin-4-yl]oxymethyl]morpholino]-3-(2-pyridyl)prop-2-en-1-one Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=NC(=N1)SC)OCC2CN(CCO2)C(=O)C=CC3=CC=CC=N3

Isomeric SMILES

COCC1=CC(=NC(=N1)SC)OCC2CN(CCO2)C(=O)C=CC3=CC=CC=N3

InChI

InChI=1S/C20H24N4O4S/c1-26-13-16-11-18(23-20(22-16)29-2)28-14-17-12-24(9-10-27-17)19(25)7-6-15-5-3-4-8-21-15/h3-8,11,17H,9-10,12-14H2,1-2H3