N-(2,5-dimethoxyphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-(6-morpholinopyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[[6-(4-morpholinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[(6-morpholinopyrimidin-4-yl)thio]acetamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=NC(=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC=NC(=C2)N3CCOCC3

InChI

InChI=1S/C18H22N4O4S/c1-24-13-3-4-15(25-2)14(9-13)21-17(23)11-27-18-10-16(19-12-20-18)22-5-7-26-8-6-22/h3-4,9-10,12H,5-8,11H2,1-2H3,(H,21,23)