N-[2-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[2-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[2-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-2-nitro-benzenesulfonamide Formula: C16H15N5O4S MolecularWeight: 373.3864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C16H15N5O4S/c1-11-10-12(2)20(18-11)16-13(6-5-9-17-16)19-26(24,25)15-8-4-3-7-14(15)21(22)23/h3-10,19H,1-2H3