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

Systemtic Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C14H18N4O4S MolecularWeight: 338.38212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O4S/c1-4-17-10-12(11(2)15-17)9-16(3)23(21,22)14-7-5-13(6-8-14)18(19)20/h5-8,10H,4,9H2,1-3H3