N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]oxane-4-carboxamide

Systemtic Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]oxane-4-carboxamide Openeye Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]tetrahydropyran-4-carboxamide CAS Name: N-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]-4-oxanecarboxamide IUPAC Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]oxane-4-carboxamide Traditional Name: N-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]tetrahydropyran-4-carboxamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)C3CCOCC3)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)C3CCOCC3)N4CCOCC4

InChI

InChI=1S/C22H28N4O5S/c1-32(28,29)15-19-14-20(26-8-12-31-13-9-26)25-21(23-19)16-2-4-18(5-3-16)24-22(27)17-6-10-30-11-7-17/h2-5,14,17H,6-13,15H2,1H3,(H,24,27)