N-(1-ethylpyrazol-4-yl)-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(1-ethylpyrazol-4-yl)-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(1-ethylpyrazol-4-yl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-(1-ethyl-4-pyrazolyl)-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(1-ethylpyrazol-4-yl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(1-ethylpyrazol-4-yl)-2-methyl-5-nitro-benzenesulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4S/c1-3-15-8-10(7-13-15)14-21(19,20)12-6-11(16(17)18)5-4-9(12)2/h4-8,14H,3H2,1-2H3