N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-nitro-benzenesulfonamide Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C)CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4S/c1-3-16-9-11(10(2)15-16)8-14-22(20,21)13-6-4-12(5-7-13)17(18)19/h4-7,9,14H,3,8H2,1-2H3