2,6-dimethyl-4-[6-(4-methylsulfonylphenoxy)-5-nitro-pyrimidin-4-yl]morpholine

Systemtic Name: 2,6-dimethyl-4-[6-(4-methylsulfonylphenoxy)-5-nitro-pyrimidin-4-yl]morpholine Openeye Name: 2,6-dimethyl-4-[6-(4-methylsulfonylphenoxy)-5-nitro-pyrimidin-4-yl]morpholine CAS Name: 2,6-dimethyl-4-[6-(4-methylsulfonylphenoxy)-5-nitro-4-pyrimidinyl]morpholine IUPAC Name: 2,6-dimethyl-4-[6-(4-methylsulfonylphenoxy)-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[6-(4-mesylphenoxy)-5-nitro-pyrimidin-4-yl]-2,6-dimethyl-morpholine Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O6S/c1-11-8-20(9-12(2)26-11)16-15(21(22)23)17(19-10-18-16)27-13-4-6-14(7-5-13)28(3,24)25/h4-7,10-12H,8-9H2,1-3H3