6-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]oxy-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]oxy-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[[1-(1-methylimidazol-4-yl)sulfonyl-4-piperidyl]oxy]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[[1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinyl]oxy]-N-(4-methylsulfonylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]oxy-N-(4-methylsulfonylphenyl)-5-nitropyrimidin-4-amine Traditional Name: (4-mesylphenyl)-[6-[[1-(1-methylimidazol-4-yl)sulfonyl-4-piperidyl]oxy]-5-nitro-pyrimidin-4-yl]amine Formula: C20H23N7O7S2 MolecularWeight: 537.56932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N2CCC(CC2)OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N2CCC(CC2)OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C20H23N7O7S2/c1-25-11-17(23-13-25)36(32,33)26-9-7-15(8-10-26)34-20-18(27(28)29)19(21-12-22-20)24-14-3-5-16(6-4-14)35(2,30)31/h3-6,11-13,15H,7-10H2,1-2H3,(H,21,22,24)