2-methyl-5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[3-(1-pyrazolylmethyl)phenyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)CN3C=CC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)CN3C=CC=N3

InChI

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