4-(2-fluorophenyl)sulfanyl-N-[(2R)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-fluorophenyl)sulfanyl-N-[(2R)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-(2-fluorophenyl)sulfanyl-N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-[(2-fluorophenyl)thio]-N-[(2R)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-fluorophenyl)sulfanyl-N-[(2R)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-fluorophenyl)thio]-N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide Formula: C16H17FN2O5S2 MolecularWeight: 400.444983

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

C[C@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C16H17FN2O5S2/c1-11(10-24-2)18-26(22,23)12-7-8-16(14(9-12)19(20)21)25-15-6-4-3-5-13(15)17/h3-9,11,18H,10H2,1-2H3/t11-/m1/s1