4-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Openeye Name: 4-nitro-N-[2-[6-(1-piperidyl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide CAS Name: 4-nitro-N-[2-[[6-(1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]benzenesulfonamide IUPAC Name: 4-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Traditional Name: 4-nitro-N-[2-(6-piperidinopyrimidin-4-yl)oxyethyl]benzenesulfonamide Formula: C17H21N5O5S MolecularWeight: 407.44414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O5S/c23-22(24)14-4-6-15(7-5-14)28(25,26)20-8-11-27-17-12-16(18-13-19-17)21-9-2-1-3-10-21/h4-7,12-13,20H,1-3,8-11H2