(2-chloranyl-4-methylsulfonyl-phenyl)-[2-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]methanone

Systemtic Name: (2-chloranyl-4-methylsulfonyl-phenyl)-[2-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]methanone Openeye Name: (2-chloro-4-methylsulfonyl-phenyl)-[2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]methanone CAS Name: (2-chloro-4-methylsulfonylphenyl)-[2-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)oxymethyl]-4-morpholinyl]methanone IUPAC Name: (2-chloro-4-methylsulfonylphenyl)-[2-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholin-4-yl]methanone Traditional Name: (2-chloro-4-mesyl-phenyl)-[2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)oxymethyl]morpholino]methanone Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)OCC2CN(CCO2)C(=O)C3=C(C=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)OCC2CN(CCO2)C(=O)C3=C(C=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H26ClN3O5S/c1-13(2)20-23-14(3)9-19(24-20)30-12-15-11-25(7-8-29-15)21(26)17-6-5-16(10-18(17)22)31(4,27)28/h5-6,9-10,13,15H,7-8,11-12H2,1-4H3