N-(3-methoxy-5-methyl-pyrazin-2-yl)-2-[4-(2-methylpropyl)-3-nitro-phenyl]benzenesulfonamide

Systemtic Name: N-(3-methoxy-5-methyl-pyrazin-2-yl)-2-[4-(2-methylpropyl)-3-nitro-phenyl]benzenesulfonamide Openeye Name: 2-(4-isobutyl-3-nitro-phenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)benzenesulfonamide CAS Name: N-(3-methoxy-5-methyl-2-pyrazinyl)-2-[4-(2-methylpropyl)-3-nitrophenyl]benzenesulfonamide IUPAC Name: N-(3-methoxy-5-methylpyrazin-2-yl)-2-[4-(2-methylpropyl)-3-nitrophenyl]benzenesulfonamide Traditional Name: 2-(4-isobutyl-3-nitro-phenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)benzenesulfonamide Formula: C22H24N4O5S MolecularWeight: 456.51476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)OC)NS(=O)(=O)C2=CC=CC=C2C3=CC(=C(C=C3)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(C(=N1)OC)NS(=O)(=O)C2=CC=CC=C2C3=CC(=C(C=C3)CC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S/c1-14(2)11-17-10-9-16(12-19(17)26(27)28)18-7-5-6-8-20(18)32(29,30)25-21-22(31-4)24-15(3)13-23-21/h5-10,12-14H,11H2,1-4H3,(H,23,25)