2-chloranyl-5-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-5-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Openeye Name: 2-chloro-5-nitro-N-[2-[6-(1-piperidyl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide CAS Name: 2-chloro-5-nitro-N-[2-[[6-(1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]benzenesulfonamide IUPAC Name: 2-chloro-5-nitro-N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]benzenesulfonamide Traditional Name: 2-chloro-5-nitro-N-[2-(6-piperidinopyrimidin-4-yl)oxyethyl]benzenesulfonamide Formula: C17H20ClN5O5S MolecularWeight: 441.8892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN5O5S/c18-14-5-4-13(23(24)25)10-15(14)29(26,27)21-6-9-28-17-11-16(19-12-20-17)22-7-2-1-3-8-22/h4-5,10-12,21H,1-3,6-9H2