[4-(5-methylpyridin-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-yl-phenyl)methanone

Systemtic Name: [4-(5-methylpyridin-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-yl-phenyl)methanone Openeye Name: [4-(5-methyl-2-pyridyl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholino-phenyl)methanone CAS Name: [4-(5-methyl-2-pyridinyl)-1-piperazinyl]-[5-methylsulfonyl-2-(4-morpholinyl)phenyl]methanone IUPAC Name: [4-(5-methylpyridin-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-morpholin-4-ylphenyl)methanone Traditional Name: (5-mesyl-2-morpholino-phenyl)-[4-(5-methyl-2-pyridyl)piperazino]methanone Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)N4CCOCC4

Isomeric SMILES

CC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)N4CCOCC4

InChI

InChI=1S/C22H28N4O4S/c1-17-3-6-21(23-16-17)25-7-9-26(10-8-25)22(27)19-15-18(31(2,28)29)4-5-20(19)24-11-13-30-14-12-24/h3-6,15-16H,7-14H2,1-2H3