N,N-diethyl-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]thio]benzenesulfonamide Formula: C19H20N4O5S2 MolecularWeight: 448.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S2/c1-4-22(5-2)30(26,27)14-10-11-17(16(12-14)23(24)25)29-19-21-20-18(28-19)15-9-7-6-8-13(15)3/h6-12H,4-5H2,1-3H3