N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-3-nitro-benzenesulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(NN=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(NN=C2C)C)[N+](=O)[O-]

InChI

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