N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-3-nitro-benzenesulfonamide CAS Name: N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethylphenyl)-4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidino]-3-nitro-benzenesulfonamide Formula: C22H25N5O5S MolecularWeight: 471.5294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)C4=NC(=NO4)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)C4=NC(=NO4)C)[N+](=O)[O-])C

InChI

InChI=1S/C22H25N5O5S/c1-14-6-8-19(15(2)11-14)25-33(30,31)18-7-9-20(21(12-18)27(28)29)26-10-4-5-17(13-26)22-23-16(3)24-32-22/h6-9,11-12,17,25H,4-5,10,13H2,1-3H3