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

Systemtic Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]ethanamide Openeye Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]acetamide CAS Name: N-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]acetamide Traditional Name: N-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]acetamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCOCC3)CS(=O)(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCOCC3)CS(=O)(=O)C

InChI

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