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

Systemtic Name: 6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[[1-(cyclopropylmethyl)-4-piperidyl]oxy]-N-(4-methylsulfonylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[[1-(cyclopropylmethyl)-4-piperidinyl]oxy]-N-(4-methylsulfonylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-N-(4-methylsulfonylphenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[[1-(cyclopropylmethyl)-4-piperidyl]oxy]-5-nitro-pyrimidin-4-yl]-(4-mesylphenyl)amine Formula: C20H25N5O5S MolecularWeight: 447.508

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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)CC4CC4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCN(CC3)CC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O5S/c1-31(28,29)17-6-4-15(5-7-17)23-19-18(25(26)27)20(22-13-21-19)30-16-8-10-24(11-9-16)12-14-2-3-14/h4-7,13-14,16H,2-3,8-12H2,1H3,(H,21,22,23)