2-methyl-5-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[(1-phenyl-4-pyrazolyl)methyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzenesulfonamide Formula: C17H16N4O4S MolecularWeight: 372.39834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O4S/c1-13-7-8-16(21(22)23)9-17(13)26(24,25)19-11-14-10-18-20(12-14)15-5-3-2-4-6-15/h2-10,12,19H,11H2,1H3