N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-nitro-benzenesulfonamide Openeye Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-nitro-benzenesulfonamide CAS Name: N-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-3-nitrobenzenesulfonamide Traditional Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-3-nitro-benzenesulfonamide Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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