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

Systemtic Name: 2-chloranyl-N-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-[2-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]oxyethyl]-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-[2-[[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-[2-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]oxyethyl]-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-[2-[6-(4-methylpiperidino)pyrimidin-4-yl]oxyethyl]-5-nitro-benzenesulfonamide Formula: C18H22ClN5O5S MolecularWeight: 455.91578

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)OCCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H22ClN5O5S/c1-13-4-7-23(8-5-13)17-11-18(21-12-20-17)29-9-6-22-30(27,28)16-10-14(24(25)26)2-3-15(16)19/h2-3,10-13,22H,4-9H2,1H3