N-(4,6-dimethylpyrimidin-2-yl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-2-nitro-benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-2-nitro-benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-2-nitro-benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C12H12N4O4S/c1-8-7-9(2)14-12(13-8)15-21(19,20)11-6-4-3-5-10(11)16(17)18/h3-7H,1-2H3,(H,13,14,15)