N-(4-methylsulfonylphenyl)-6-(1-methylsulfonylpiperidin-4-yl)oxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(4-methylsulfonylphenyl)-6-(1-methylsulfonylpiperidin-4-yl)oxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(4-methylsulfonylphenyl)-6-[(1-methylsulfonyl-4-piperidyl)oxy]-5-nitro-pyrimidin-4-amine CAS Name: N-(4-methylsulfonylphenyl)-6-[(1-methylsulfonyl-4-piperidinyl)oxy]-5-nitro-4-pyrimidinamine IUPAC Name: N-(4-methylsulfonylphenyl)-6-(1-methylsulfonylpiperidin-4-yl)oxy-5-nitropyrimidin-4-amine Traditional Name: (4-mesylphenyl)-[6-[(1-mesyl-4-piperidyl)oxy]-5-nitro-pyrimidin-4-yl]amine Formula: C17H21N5O7S2 MolecularWeight: 471.50794

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCN(CC3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCN(CC3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O7S2/c1-30(25,26)14-5-3-12(4-6-14)20-16-15(22(23)24)17(19-11-18-16)29-13-7-9-21(10-8-13)31(2,27)28/h3-6,11,13H,7-10H2,1-2H3,(H,18,19,20)