3-cyclopropyl-N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]propanamide

Systemtic Name: 3-cyclopropyl-N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]propanamide Openeye Name: 3-cyclopropyl-N-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]propanamide CAS Name: 3-cyclopropyl-N-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]propanamide IUPAC Name: 3-cyclopropyl-N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]propanamide Traditional Name: 3-cyclopropyl-N-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]propionamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)CCC3CC3)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)CCC3CC3)N4CCOCC4

InChI

InChI=1S/C22H28N4O4S/c1-31(28,29)15-19-14-20(26-10-12-30-13-11-26)25-22(24-19)17-5-7-18(8-6-17)23-21(27)9-4-16-2-3-16/h5-8,14,16H,2-4,9-13,15H2,1H3,(H,23,27)