N-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C14H16N4O5S MolecularWeight: 352.36564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H16N4O5S/c1-10-8-11(2)17(15-10)14(19)9-16(3)24(22,23)13-6-4-12(5-7-13)18(20)21/h4-8H,9H2,1-3H3