N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-yl-pyrimidin-2-yl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[4-(methylsulfonylmethyl)-6-(4-morpholinyl)-2-pyrimidinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[4-(mesylmethyl)-6-morpholino-pyrimidin-2-yl]phenyl]nicotinamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)C3=CN=CC=C3)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)CC1=CC(=NC(=N1)C2=CC=C(C=C2)NC(=O)C3=CN=CC=C3)N4CCOCC4

InChI

InChI=1S/C22H23N5O4S/c1-32(29,30)15-19-13-20(27-9-11-31-12-10-27)26-21(24-19)16-4-6-18(7-5-16)25-22(28)17-3-2-8-23-14-17/h2-8,13-14H,9-12,15H2,1H3,(H,25,28)